data_2kyu_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kyu _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.469 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 5.7 mtp . . . . . 0 C--O 1.228 -0.04 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.72 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.477 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.72 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.493 HG11 ' OE2' ' A' ' 39' ' ' GLU . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.799 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.799 ' HB2' ' O ' ' A' ' 36' ' ' SER . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.739 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.739 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.632 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.597 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.645 HD12 ' CG2' ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.653 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.653 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.645 ' CG2' HD12 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.421 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.621 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.42 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m . . . . . 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.849 0.357 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.707 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.775 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.775 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.707 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' HB2' ' A' ' 39' ' ' GLU . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.788 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.46 ' C ' ' H ' ' A' ' 40' ' ' ASN . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.611 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.46 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.788 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.698 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.572 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.692 ' O ' HD12 ' A' ' 52' ' ' LEU . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 48' ' ' ILE . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.671 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.671 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.446 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.669 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.654 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.77 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.726 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.726 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.472 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.77 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.487 HG12 ' HB2' ' A' ' 39' ' ' GLU . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.748 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.487 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.748 ' HB2' ' O ' ' A' ' 36' ' ' SER . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.634 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.634 ' HG2' ' CB ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.496 ' O ' HD11 ' A' ' 52' ' ' LEU . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.496 HD11 ' O ' ' A' ' 48' ' ' ILE . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.699 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.699 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.442 HG23 ' CD1' ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.419 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.674 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.48 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.464 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m . . . . . 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.497 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 98.8 mtp . . . . . 0 CA--C 1.523 -0.067 0 CA-C-O 120.726 0.298 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.764 ' HE3' ' CE1' ' A' ' 46' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.423 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG13 ' HB2' ' A' ' 39' ' ' GLU . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.544 ' CG ' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.805 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.544 ' HB3' ' CG ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.625 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.805 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.859 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.859 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.764 ' CE1' ' HE3' ' A' ' 25' ' ' MET . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.632 ' O ' HD12 ' A' ' 52' ' ' LEU . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.428 HG22 HD11 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.645 ' CG ' ' HG2' ' A' ' 25' ' ' MET . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.53 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m . . . . . 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.665 0.269 . . . . 0.0 110.871 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.834 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.646 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.77 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.646 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.834 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.403 HG22 ' CB ' ' A' ' 60' ' ' CYS . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.41 ' N ' ' HG ' ' A' ' 36' ' ' SER . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HG2' ' HH ' ' A' ' 58' ' ' TYR . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.719 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.719 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.594 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.621 ' O ' HD12 ' A' ' 52' ' ' LEU . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.63 HD11 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.664 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.63 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.45 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.796 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.405 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.403 ' CB ' HG22 ' A' ' 34' ' ' VAL . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m . . . . . 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.455 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 41.3 mtp . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.765 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.442 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.768 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.529 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.687 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.768 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HE ' ' HB2' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.869 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.452 ' C ' ' H ' ' A' ' 40' ' ' ASN . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.869 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.723 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.746 ' CE1' ' HE2' ' A' ' 25' ' ' MET . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.605 ' O ' HD11 ' A' ' 52' ' ' LEU . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.556 ' CD2' ' HA ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.605 HD11 ' O ' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.621 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.481 ' CG2' HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.435 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.765 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.529 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m . . . . . 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.445 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 91.0 mtp . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.508 0.194 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.735 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.525 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.781 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.45 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.732 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG21 ' CB ' ' A' ' 60' ' ' CYS . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.72 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.72 ' HB2' ' O ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.733 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.733 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.703 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.673 HG21 HD11 ' A' ' 52' ' ' LEU . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.715 HD11 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.673 HD11 HG21 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.688 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.688 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.425 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.425 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.735 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.445 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.421 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.525 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m . . . . . 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.662 0.268 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.707 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.789 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.576 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.789 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.528 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.458 HG12 ' HB2' ' A' ' 39' ' ' GLU . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.847 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.602 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.847 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.707 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.632 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.632 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.433 ' HD2' ' CD2' ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.402 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.403 ' CB ' HG22 ' A' ' 34' ' ' VAL . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m . . . . . 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.69 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 9.9 mtp . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.778 0.323 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.729 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.763 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.503 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.729 ' HA ' ' O ' ' A' ' 25' ' ' MET . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.535 ' C ' ' HE3' ' A' ' 24' ' ' MET . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.552 ' N ' ' HE3' ' A' ' 24' ' ' MET . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.755 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 40' ' ' ASN . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.664 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 36' ' ' SER . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.582 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.662 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.662 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.444 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.444 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.672 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.44 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 92.8 mtp . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.724 0.297 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' MET . . . . . 0.786 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.711 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.711 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.533 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.465 ' HB ' ' HH ' ' A' ' 58' ' ' TYR . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . 0.477 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.835 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.455 ' N ' ' HG ' ' A' ' 36' ' ' SER . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.632 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.835 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.949 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.949 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.649 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.581 ' O ' HD13 ' A' ' 52' ' ' LEU . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . 0.667 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.482 HG21 ' CD1' ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.454 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.786 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.469 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.42 -0.272 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.407 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 81.4 p -79.81 -35.18 38.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.786 0.327 . . . . 0.0 110.836 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.05 29.64 17.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.973 0.416 . . . . 0.0 111.133 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' -1' ' ' SER . 3.2 mmtt -123.1 -172.24 2.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 172.5 -18.98 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.573 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 54.5 176.97 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.892 0.377 . . . . 0.0 111.252 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -144.91 148.49 33.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.413 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.654 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -55.82 131.58 72.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.672 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' HD2' HG12 ' A' ' 34' ' ' VAL . 59.1 Cg_endo -74.09 -3.68 14.19 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.517 2.811 . . . . 0.0 114.006 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.673 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -95.23 -50.83 4.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 179.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 p -155.64 -48.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.973 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.715 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 3.4 p-10 50.66 41.44 25.89 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.65 -102.04 0.12 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.72 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.636 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.7 t -175.4 100.23 0.08 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.573 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.636 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 79.13 -42.1 0.28 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.697 0.761 . . . . 0.0 110.461 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.462 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.6 OUTLIER 59.69 85.12 0.11 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.291 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.75 -3.97 58.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.911 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.583 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 22.3 p-10 -125.83 47.53 2.22 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.099 0.475 . . . . 0.0 110.381 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.81 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 6.4 m-20 -65.68 -13.16 58.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.551 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.583 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 7.2 p90 -70.1 -38.31 75.6 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.763 0.792 . . . . 0.0 109.945 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.44 -6.02 21.08 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.093 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.81 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 31.6 m -74.27 99.25 3.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.615 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.7 OUTLIER -54.81 90.3 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.198 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.535 ' HE1' ' N ' ' A' ' 8' ' ' CYS . 5.7 mtp -113.49 156.98 22.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.331 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.72 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.477 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.72 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.493 HG11 ' OE2' ' A' ' 39' ' ' GLU . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.715 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.799 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.799 ' HB2' ' O ' ' A' ' 36' ' ' SER . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.739 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.739 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.632 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.597 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.608 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.645 HD12 ' CG2' ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.653 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.653 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.645 ' CG2' HD12 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.421 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.621 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.42 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.514 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m -69.09 -39.17 79.19 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.2 -10.34 59.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.916 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 -167.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.827 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.29 76.72 0.36 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 -179.571 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 CA-C-O 120.515 -0.047 . . . . 0.0 113.035 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.2 -27.52 8.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.767 0.318 . . . . 0.0 110.64 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.33 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.043 0.449 . . . . 0.0 110.944 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -132.85 -28.43 1.57 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.068 -179.762 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' C ' HH11 ' A' ' 32' ' ' ARG . . . -82.63 47.89 3.87 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.131 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 1.024 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 1.7 m-20 -67.51 100.01 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.815 0.34 . . . . 0.0 111.527 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -166.59 157.67 12.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.842 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.8 t -56.43 116.71 13.56 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.167 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -70.04 -3.79 12.91 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.877 2.385 . . . . 0.0 112.671 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.428 HD13 ' C ' ' A' ' 38' ' ' CYS . 10.1 mt -91.71 -49.92 6.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.772 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.3 p -156.17 -43.7 0.08 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.721 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 3.1 p30 49.8 22.18 0.79 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.569 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 1.037 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.5 OUTLIER 59.0 144.86 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.402 0.62 . . . . 0.0 110.588 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.8 OUTLIER -67.06 90.68 0.2 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.683 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.609 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 3.8 m-85 78.63 -38.87 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.521 0.677 . . . . 0.0 110.367 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 1.037 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 18.7 t0 43.13 95.2 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.37 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.89 -4.69 45.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.572 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.692 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.2 p30 -111.66 38.62 2.57 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.979 0.419 . . . . 0.0 110.927 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.849 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 0.3 OUTLIER -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.413 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.692 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 18.7 p90 -70.62 -41.61 72.02 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.983 0.896 . . . . 0.0 109.658 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -97.21 -3.83 40.11 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.027 -1.442 . . . . 0.0 109.947 179.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.849 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -68.06 100.57 1.01 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.254 0.55 . . . . 0.0 110.017 179.703 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.541 ' HB3' ' OG ' ' A' ' 36' ' ' SER . 0.0 OUTLIER -58.41 86.1 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.633 -179.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.489 ' HG3' ' O ' ' A' ' 22' ' ' SER . 73.9 mtp -116.37 159.08 22.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.802 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.707 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.693 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.58 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.775 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.693 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 1.024 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.707 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.447 HG13 ' HB2' ' A' ' 39' ' ' GLU . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.761 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.788 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.46 ' C ' ' H ' ' A' ' 40' ' ' ASN . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.611 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.46 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.788 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.698 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.572 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.692 ' O ' HD12 ' A' ' 52' ' ' LEU . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.565 ' CD2' ' HA ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.692 HD12 ' O ' ' A' ' 48' ' ' ILE . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.671 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.671 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.637 HG23 HD11 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.446 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.669 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.424 ' HB ' ' CG2' ' A' ' 64' ' ' THR . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.507 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m -69.05 -39.36 79.19 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.507 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 24.5 p -74.73 -8.66 57.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.323 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 46.96 -170.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.645 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -165.71 121.47 1.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.1 m -150.47 105.22 3.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 110.964 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.62 156.26 42.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt 62.34 -172.59 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.63 127.02 1.69 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.576 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -162.72 106.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.925 0.393 . . . . 0.0 111.053 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.659 ' HE1' ' HA ' ' A' ' 15' ' ' TYR . 45.8 m-85 -146.46 115.62 7.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.655 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.587 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -59.73 179.74 0.19 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.069 179.231 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.491 ' CD ' HG11 ' A' ' 34' ' ' VAL . 73.6 Cg_endo -99.39 13.83 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.927 3.085 . . . . 0.0 114.835 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.484 HD12 ' SG ' ' A' ' 38' ' ' CYS . 2.2 mt -136.71 -57.91 0.73 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.125 0.488 . . . . 0.0 110.758 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 p -136.04 -67.87 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.612 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.781 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 38.7 t70 69.06 44.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.365 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.71 ' HE2' ' H ' ' A' ' 17' ' ' ASP . 0.1 OUTLIER 46.49 18.88 0.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.309 179.151 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 4.5 m 56.79 104.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.659 ' HA ' ' HE1' ' A' ' 7' ' ' PHE . 11.3 m-85 80.08 -39.25 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.467 0.651 . . . . 0.0 111.205 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.688 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 44.2 t0 47.22 96.96 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.253 -0.885 . . . . 0.0 112.387 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.71 ' H ' ' HE2' ' A' ' 13' ' ' LYS . 1.1 m-20 -99.73 -6.51 26.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.654 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.63 ' O ' ' HB2' ' A' ' 22' ' ' SER . 1.0 OUTLIER -133.85 46.5 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.214 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.576 ' HB2' ' HG3' ' A' ' 24' ' ' MET . 9.3 p-10 -64.97 -13.58 57.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.87 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.513 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 2.9 p90 -69.67 -37.43 76.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.73 0.776 . . . . 0.0 109.972 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -111.29 -5.79 14.62 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.322 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.63 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.1 OUTLIER -75.63 10.44 1.73 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.286 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.561 ' CG ' ' HB3' ' A' ' 36' ' ' SER . 3.7 tptt 59.0 65.83 1.15 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.359 . . . . 0.0 111.154 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.654 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm -108.33 151.38 26.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.77 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.726 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.48 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.472 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.726 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.472 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.77 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.491 HG11 ' CD ' ' A' ' 9' ' ' PRO . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.781 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.748 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' HD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.484 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.487 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.748 ' HB2' ' O ' ' A' ' 36' ' ' SER . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.634 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.634 ' HG2' ' CB ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.624 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.496 ' O ' HD11 ' A' ' 52' ' ' LEU . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.614 HD22 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.496 HD11 ' O ' ' A' ' 48' ' ' ILE . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.699 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.699 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.442 HG23 ' CD1' ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.419 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.674 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.48 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.427 ' O ' ' HB ' ' A' ' 64' ' ' THR . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.531 HG22 ' OE1' ' A' ' 65' ' ' GLU . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.464 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m -69.39 -39.84 77.76 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 64' ' ' THR . 0.8 OUTLIER -75.42 -5.03 42.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.954 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.531 ' OE1' HG22 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -65.32 138.91 58.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.743 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -79.05 -72.72 0.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.128 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.773 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.137 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.7 p -153.17 36.9 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 0.0 110.832 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.46 146.99 50.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.74 -175.33 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.015 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.83 132.48 3.47 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.447 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 7' ' ' PHE . 23.7 p30 -160.2 92.51 1.0 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.735 0.302 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.592 ' HA ' ' HE3' ' A' ' 24' ' ' MET . 86.0 m-85 -158.03 137.75 12.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.143 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.705 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 0.3 OUTLIER -54.73 122.15 38.32 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -67.95 -3.87 11.36 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.276 2.65 . . . . 0.0 112.756 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.728 HD13 ' SG ' ' A' ' 38' ' ' CYS . 0.6 OUTLIER -92.17 -53.23 4.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.875 179.365 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.8 p -156.64 -54.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.592 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.736 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 54.2 t0 64.98 47.61 2.52 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.768 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.79 -93.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.006 0.431 . . . . 0.0 110.587 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.609 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.24 69.69 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.79 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.609 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 26.5 m-85 78.46 -44.98 0.39 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.459 0.647 . . . . 0.0 110.688 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 14' ' ' CYS . 0.5 OUTLIER 58.23 167.79 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.22 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -101.58 -5.48 25.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.29 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.557 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 16.7 p30 -160.43 64.05 0.32 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.915 0.388 . . . . 0.0 110.46 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -65.73 -14.67 61.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.573 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.557 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.7 p90 -70.53 -41.84 72.0 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 109.845 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.516 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -103.92 0.12 29.7 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.524 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 39.2 p -70.48 26.53 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.558 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.1 OUTLIER 59.59 72.92 0.5 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.05 0.452 . . . . 0.0 110.719 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.592 ' HE3' ' HA ' ' A' ' 7' ' ' PHE . 98.8 mtp -134.32 156.99 47.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.548 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.764 ' HE3' ' CE1' ' A' ' 46' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.423 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.53 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.653 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.614 ' HA ' ' HA ' ' A' ' 8' ' ' CYS . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.805 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.728 ' SG ' HD13 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.625 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.805 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.859 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.859 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.764 ' CE1' ' HE3' ' A' ' 25' ' ' MET . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.632 ' O ' HD12 ' A' ' 52' ' ' LEU . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.428 HG22 HD11 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.645 ' CG ' ' HG2' ' A' ' 25' ' ' MET . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.632 HG21 HG22 ' A' ' 64' ' ' THR . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.708 HG13 HD22 ' A' ' 10' ' ' LEU . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.53 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m -68.76 -40.05 79.94 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.632 HG22 HG21 ' A' ' 59' ' ' THR . 3.9 p -75.57 -12.77 60.29 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.652 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 47.21 97.6 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.727 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.586 ' HG2' ' H ' ' A' ' 67' ' ' HIS . 9.6 ttm180 61.74 168.51 0.11 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.905 0.383 . . . . 0.0 111.003 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.586 ' H ' ' HG2' ' A' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.923 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.686 -0.166 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 26.3 t 61.32 82.63 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 0.0 110.81 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.91 -170.18 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -31.39 62.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.114 0.483 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.447 ' HA2' ' CG ' ' A' ' 32' ' ' ARG . . . 80.95 -154.44 35.51 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.687 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.854 ' HA ' ' HB2' ' A' ' 33' ' ' TRP . 0.2 OUTLIER 62.24 83.64 0.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.786 0.327 . . . . 0.0 111.174 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' CD2' ' O ' ' A' ' 6' ' ' ASN . 7.1 m-85 -170.86 107.85 0.29 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.126 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.749 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 2.0 t -59.78 118.32 30.86 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' HG2' HG12 ' A' ' 61' ' ' VAL . 39.5 Cg_endo -68.94 -4.92 14.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.996 2.464 . . . . 0.0 112.844 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 10.7 mt -91.98 -50.22 5.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.5 p -156.16 -45.1 0.08 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.012 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.675 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 1.9 p30 52.33 16.4 0.59 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.242 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.855 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 59.65 144.91 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.255 0.55 . . . . 0.0 111.081 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.635 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.8 t -72.48 71.33 0.94 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.726 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.635 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 39.9 m-85 80.16 -47.26 0.32 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.42 0.628 . . . . 0.0 109.875 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.594 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 31.6 t0 62.76 -7.6 0.14 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.484 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.476 ' H ' ' C ' ' A' ' 15' ' ' TYR . 3.0 t70 62.91 -2.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.53 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.3 m-20 -146.23 54.35 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.318 . . . . 0.0 111.279 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' SER . 31.8 m-20 -67.37 -15.18 63.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.909 0.385 . . . . 0.0 111.35 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.53 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 22.2 p90 -71.76 -45.13 62.68 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.809 0.814 . . . . 0.0 108.982 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.457 ' OE1' ' HE1' ' A' ' 20' ' ' TYR . 1.3 mt-10 -82.4 -5.56 58.72 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.485 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.491 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 3.6 m -67.59 99.88 0.82 Allowed 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.971 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.641 ' HG2' ' OG ' ' A' ' 36' ' ' SER . 1.9 tptm -51.69 89.0 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.964 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp -124.21 165.49 17.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.834 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.427 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.77 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.544 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.646 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.77 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.646 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.854 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.403 HG22 ' CB ' ' A' ' 60' ' ' CYS . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.749 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.41 ' N ' ' HG ' ' A' ' 36' ' ' SER . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.456 ' HG2' ' HH ' ' A' ' 58' ' ' TYR . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.719 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.719 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.594 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.621 ' O ' HD12 ' A' ' 52' ' ' LEU . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.63 HD11 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.779 HD11 HG22 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.664 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.664 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.63 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.779 HG22 HD11 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.45 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.796 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.502 ' HB ' ' HG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.405 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.458 HG12 ' HG2' ' A' ' 9' ' ' PRO . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m -68.97 -39.66 79.32 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.546 ' O ' HG23 ' A' ' 64' ' ' THR . 0.8 OUTLIER -75.65 0.37 17.84 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.02 179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 7.1 0.55 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 64' ' ' THR . 13.4 ttm180 -166.05 120.42 1.17 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 0.0 110.459 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.3 p -143.01 139.66 30.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.835 0.35 . . . . 0.0 110.968 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 49.55 97.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.41 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -116.35 159.32 22.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 0.0 111.122 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.56 -138.02 13.92 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.912 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.667 ' N ' ' HG3' ' A' ' 32' ' ' ARG . 13.5 m120 64.96 58.79 0.9 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.319 0.581 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.756 ' HA ' ' HE1' ' A' ' 24' ' ' MET . 33.2 m-85 -156.87 167.77 29.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.203 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.728 ' HB3' ' CA ' ' A' ' 12' ' ' ASP . 13.6 t -60.92 117.84 29.54 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.826 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HG3' HG12 ' A' ' 61' ' ' VAL . 43.2 Cg_endo -68.51 -6.03 16.66 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.198 2.599 . . . . 0.0 112.559 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.02 -49.4 6.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.79 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 p -156.1 -42.48 0.08 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.851 0.358 . . . . 0.0 111.412 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.728 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.9 p30 50.74 22.06 1.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.566 -179.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.645 ' HZ1' ' HA ' ' A' ' 16' ' ' ASP . 0.8 OUTLIER 67.45 -19.91 0.12 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.868 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.9 OUTLIER 62.02 124.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 179.322 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 19.6 m-85 82.5 -26.04 0.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.413 0.625 . . . . 0.0 111.08 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.645 ' HA ' ' HZ1' ' A' ' 13' ' ' LYS . 4.5 t0 -38.93 100.23 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.936 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.84 -5.4 59.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.314 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.451 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 46.5 m-20 -104.6 35.54 2.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.931 0.396 . . . . 0.0 110.741 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.597 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 13.5 p-10 -65.19 -15.13 62.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.926 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.451 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 4.8 p90 -69.96 -40.36 75.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.704 0.764 . . . . 0.0 109.662 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -105.05 -3.82 22.71 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.343 178.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.497 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 5.5 t -69.54 11.69 0.24 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.699 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 36' ' ' SER . 1.1 tptt 63.53 65.76 0.73 Allowed 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.795 0.331 . . . . 0.0 111.276 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.756 ' HE1' ' HA ' ' A' ' 7' ' ' PHE . 41.3 mtp -123.02 161.85 23.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.242 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.765 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.442 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.768 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.529 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.687 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.768 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.687 ' HE ' ' HB2' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.763 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.667 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.869 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.452 ' C ' ' H ' ' A' ' 40' ' ' ASN . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.626 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.869 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.723 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.746 ' CE1' ' HE2' ' A' ' 25' ' ' MET . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.605 ' O ' HD11 ' A' ' 52' ' ' LEU . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.556 ' CD2' ' HA ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.605 HD11 ' O ' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.621 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.621 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.481 ' CG2' HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.435 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.765 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.529 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.454 HG12 ' HG3' ' A' ' 9' ' ' PRO . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m -68.72 -40.01 80.13 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.505 ' O ' HG21 ' A' ' 64' ' ' THR . 0.8 OUTLIER -75.55 -3.84 36.5 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.1 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 96.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.694 0.283 . . . . 0.0 110.873 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.53 ' CB ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -168.25 -56.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.969 0.414 . . . . 0.0 110.907 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.9 p80 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.679 -179.832 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' SER . . . . . 0.544 ' HG ' ' H ' ' A' ' 3' ' ' ALA . 11.3 p -156.62 -72.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 111.234 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.544 ' H ' ' HG ' ' A' ' -1' ' ' SER . . . 60.85 158.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.97 0.414 . . . . 0.0 111.105 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.01 166.63 10.95 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.734 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.511 ' O ' ' HD2' ' A' ' 32' ' ' ARG . . . -169.93 154.44 23.42 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.099 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.91 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 12.9 p30 -168.3 94.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.465 178.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.578 ' HA ' ' HE2' ' A' ' 24' ' ' MET . 6.3 m-85 -163.4 160.07 23.06 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.6 t -58.96 115.81 13.32 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.12 -4.02 13.43 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.088 2.525 . . . . 0.0 112.713 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 7.5 mt -91.66 -49.28 6.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.706 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 p -156.34 -43.16 0.07 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.066 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.721 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 2.8 p30 49.23 28.18 2.13 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.48 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.913 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.2 OUTLIER 60.35 139.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.958 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -73.22 87.22 1.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.376 179.584 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.619 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.9 m-85 77.77 -44.83 0.43 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.492 0.663 . . . . 0.0 110.027 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.913 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 29.1 t0 54.25 167.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.046 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -134.53 -2.93 2.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.374 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -131.56 47.59 2.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.682 0.277 . . . . 0.0 111.505 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.842 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 3.1 m-20 -65.57 -17.05 64.29 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.961 0.41 . . . . 0.0 111.226 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.577 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 8.8 p90 -70.55 -41.84 71.94 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.704 0.764 . . . . 0.0 109.134 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -91.9 -4.11 55.14 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.901 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.842 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -67.61 98.19 0.67 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.265 0.555 . . . . 0.0 110.467 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 85.85 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.558 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.578 ' HE2' ' HA ' ' A' ' 7' ' ' PHE . 91.0 mtp -111.91 159.22 18.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.263 . . . . 0.0 110.747 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.735 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.781 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.525 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.781 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.91 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.732 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG21 ' CB ' ' A' ' 60' ' ' CYS . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.72 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.72 ' HB2' ' O ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.733 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.733 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.703 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.673 HG21 HD11 ' A' ' 52' ' ' LEU . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.715 HD11 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.673 HD11 HG21 ' A' ' 48' ' ' ILE . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.688 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.688 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.425 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.425 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.735 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.445 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.421 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' ' N ' ' A' ' 65' ' ' GLU . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.525 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m -68.79 -41.11 79.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.533 ' CG2' ' N ' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -76.66 -75.83 0.18 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.476 -179.563 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.533 ' N ' ' CG2' ' A' ' 64' ' ' THR . 3.0 pt-20 -175.64 126.38 0.23 Allowed 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.782 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.42 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . 0.6 OUTLIER -74.81 -9.01 58.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.427 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.711 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.1 t -138.92 141.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 0.0 110.948 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.71 105.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.997 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.602 ' HE3' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -135.24 96.85 3.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.687 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.04 -100.79 2.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.143 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.705 ' OD1' ' HA ' ' A' ' 32' ' ' ARG . 0.6 OUTLIER 69.2 142.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.98 0.419 . . . . 0.0 110.868 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.46 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 1.7 p90 -163.85 150.08 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.762 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.77 152.36 19.75 Favored Pre-proline 0 N--CA 1.448 -0.538 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.633 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.791 ' HG2' HG13 ' A' ' 61' ' ' VAL . 9.2 Cg_endo -88.28 1.23 6.59 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 124.271 3.314 . . . . 0.0 114.542 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.52 HD22 ' N ' ' A' ' 10' ' ' LEU . 0.2 OUTLIER -106.48 -59.86 1.74 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.082 0.468 . . . . 0.0 110.811 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.2 p -139.48 -51.98 0.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.784 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 5.0 p-10 47.8 28.49 1.35 Allowed 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.197 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.938 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 60.09 140.19 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.902 178.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 6.8 t -70.62 72.78 0.53 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.324 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 23.1 m-85 83.69 -39.91 0.08 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.553 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.883 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 2.4 p30 49.41 177.45 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.896 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.72 -7.07 3.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.423 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.729 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 2.4 p30 -123.3 43.77 2.86 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.059 0.457 . . . . 0.0 110.642 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.539 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 1.5 p30 -65.43 -17.58 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.729 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 16.5 p90 -69.84 -53.09 19.75 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.847 0.832 . . . . 0.0 109.809 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.648 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 5.0 pt-20 -84.64 -0.95 55.26 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.89 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 1.4 m -67.57 97.87 0.63 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.925 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.474 ' HG2' ' HG ' ' A' ' 36' ' ' SER . 8.2 tptm -52.83 90.46 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.476 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.473 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp -109.5 161.8 14.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.205 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.707 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.789 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.576 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.528 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.789 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.705 ' HA ' ' OD1' ' A' ' 6' ' ' ASN . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.458 HG12 ' HB2' ' A' ' 39' ' ' GLU . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.784 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.847 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.602 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.847 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.709 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.707 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.632 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.632 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.433 ' HD2' ' CD2' ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.402 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.402 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.497 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.791 HG13 ' HG2' ' A' ' 9' ' ' PRO . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m -69.58 -39.7 77.18 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.05 -10.46 59.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.045 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 56.71 167.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.397 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 62.94 162.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.952 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.514 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 CA-C-O 120.286 -0.175 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.53 84.14 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.981 0.419 . . . . 0.0 110.898 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.51 174.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.9 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -165.53 121.9 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.68 132.3 3.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.007 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.737 ' HB3' ' H ' ' A' ' 33' ' ' TRP . 2.5 m-20 63.04 106.36 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.947 0.403 . . . . 0.0 111.086 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -170.8 151.75 3.52 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.372 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.764 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 7.6 t -59.23 115.85 13.77 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.791 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.73 -3.28 12.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.776 2.318 . . . . 0.0 112.755 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' C ' ' A' ' 38' ' ' CYS . 11.5 mt -91.89 -49.48 6.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.734 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.2 p -156.19 -41.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.706 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 p30 49.11 26.53 1.46 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.689 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.474 ' HE2' ' O ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 62.96 -1.41 0.49 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.478 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.7 OUTLIER 79.98 103.34 0.07 Allowed 'General case' 0 N--CA 1.462 0.126 0 O-C-N 122.377 -0.202 . . . . 0.0 110.844 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.646 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 81.28 -42.56 0.17 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.386 0.612 . . . . 0.0 110.883 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 t0 53.17 93.83 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.36 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -93.77 -5.76 47.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.907 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.716 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 6.9 p-10 -141.6 47.19 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.107 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.464 ' HA ' ' CB ' ' A' ' 22' ' ' SER . 2.7 p30 -65.08 -14.26 60.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.965 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.716 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.3 p90 -69.78 -40.54 75.99 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.644 0.735 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.3 pt-20 -106.6 -5.07 18.95 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.516 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.526 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 3.3 t -71.27 5.92 1.97 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.363 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.44 58.11 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.551 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.69 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 9.9 mtp -109.84 160.65 16.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.51 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.729 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.597 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.503 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.763 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.555 ' CB ' ' HA ' ' A' ' 6' ' ' ASN . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.737 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.535 ' C ' ' HE3' ' A' ' 24' ' ' MET . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.764 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.755 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 40' ' ' ASN . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.664 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.755 ' HB2' ' O ' ' A' ' 36' ' ' SER . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.746 ' HG3' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.571 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.582 ' O ' HD13 ' A' ' 52' ' ' LEU . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.686 HD23 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.582 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.662 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.662 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.444 ' CG1' ' H ' ' A' ' 57' ' ' ALA . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.444 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.672 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.546 HG21 HG23 ' A' ' 64' ' ' THR . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m -68.67 -40.87 79.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.546 HG23 HG21 ' A' ' 59' ' ' THR . 1.0 OUTLIER -73.93 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.194 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 64' ' ' THR . 2.7 mt-10 75.31 99.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.721 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -78.32 -58.09 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.825 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 p80 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.909 179.987 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.6 m 59.28 91.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.928 0.394 . . . . 0.0 111.189 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.54 -30.24 0.55 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.237 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.11 175.15 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.332 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 142.77 82.74 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.17 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -74.62 109.18 7.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.702 0.287 . . . . 0.0 110.768 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.558 ' HA ' ' OD2' ' A' ' 12' ' ' ASP . 0.2 OUTLIER -161.82 113.59 1.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.919 0.39 . . . . 0.0 111.714 -179.916 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.786 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.59 163.91 1.75 Allowed Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.47 ' HB2' ' CG1' ' A' ' 61' ' ' VAL . 23.7 Cg_endo -94.9 -0.14 2.65 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.054 3.169 . . . . 0.0 115.009 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.503 ' CD2' HG13 ' A' ' 61' ' ' VAL . 0.1 OUTLIER -111.68 -53.35 2.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.293 0.568 . . . . 0.0 110.423 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.2 p -143.34 -65.56 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.044 -179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.755 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 35.1 t70 68.26 37.13 2.89 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.927 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 1.002 ' HB3' ' HB3' ' A' ' 16' ' ' ASP . 0.0 OUTLIER 62.3 144.81 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.436 179.723 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.652 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -68.95 91.64 0.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.745 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.652 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 10.7 m-85 81.38 -39.21 0.13 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.502 0.668 . . . . 0.0 109.608 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 1.002 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 6.9 p-10 44.41 101.5 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.536 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -89.01 -4.21 58.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.788 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.861 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 62.2 m-20 -116.24 41.66 2.57 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.08 0.467 . . . . 0.0 111.13 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.579 ' HA ' ' OG ' ' A' ' 22' ' ' SER . 6.7 t70 -65.5 -14.79 61.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.311 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.861 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 9.1 p90 -70.17 -40.87 74.42 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.735 0.779 . . . . 0.0 109.367 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -96.72 -3.22 42.9 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.905 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.579 ' OG ' ' HA ' ' A' ' 19' ' ' ASP . 58.8 m -67.67 97.75 0.64 Allowed 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.537 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 85.6 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.579 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 92.8 mtp -115.16 163.74 15.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.751 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' MET . . . . . 0.786 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.711 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.711 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.533 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.465 ' HB ' ' HH ' ' A' ' 58' ' ' TYR . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.786 ' H ' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.835 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.455 ' N ' ' HG ' ' A' ' 36' ' ' SER . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.477 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.632 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.835 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.949 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.949 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.649 ' CE2' ' HE3' ' A' ' 25' ' ' MET . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.581 ' O ' HD13 ' A' ' 52' ' ' LEU . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.581 HD13 ' O ' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . 0.667 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.667 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.482 HG21 ' CD1' ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.454 ' H ' ' CG1' ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.786 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.469 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.513 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.503 HG13 ' CD2' ' A' ' 10' ' ' LEU . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m -69.14 -39.8 78.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.513 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.33 -7.97 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.068 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 45.69 101.34 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 112.128 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.404 HH21 ' CD2' ' A' ' 67' ' ' HIS . 0.0 OUTLIER -72.84 -14.54 61.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.001 179.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.404 ' CD2' HH21 ' A' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.078 0 CA-C-O 120.714 0.292 . . . . 0.0 110.731 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 5.7 mtp . . . . . 0 C--O 1.228 -0.04 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.744 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.706 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.744 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.513 HG11 ' OE2' ' A' ' 39' ' ' GLU . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.813 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.814 HD11 ' CE2' ' A' ' 58' ' ' TYR . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.79 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.906 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.655 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.906 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.641 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.793 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.666 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.793 HG21 HD13 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.701 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.814 ' CE2' HD11 ' A' ' 41' ' ' LEU . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.497 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m . . . . . 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.849 0.357 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.728 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.796 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.796 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.728 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.43 ' C ' ' H ' ' A' ' 40' ' ' ASN . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.803 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.724 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.89 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.727 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.685 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.848 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.693 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.436 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.678 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.791 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.74 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.74 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.502 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 39' ' ' GLU . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.762 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.543 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.928 HD11 ' CE2' ' A' ' 58' ' ' TYR . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.662 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.789 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.652 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 45' ' ' MET . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.714 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.921 HD13 HG21 ' A' ' 56' ' ' VAL . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.711 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.921 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.715 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.928 ' CE2' HD11 ' A' ' 41' ' ' LEU . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.486 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.483 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m . . . . . 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.53 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 98.8 mtp . . . . . 0 CA--C 1.523 -0.067 0 CA-C-O 120.726 0.298 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.685 ' HG2' ' CG ' ' A' ' 58' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.722 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.722 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.61 HG11 ' OE1' ' A' ' 39' ' ' GLU . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.544 ' CG ' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.817 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.544 ' HB3' ' CG ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.817 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.912 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.912 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.842 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.671 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.866 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.689 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.689 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.866 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.718 ' HE2' HD21 ' A' ' 41' ' ' LEU . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.403 HG13 ' N ' ' A' ' 62' ' ' ASN . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HG13 ' A' ' 61' ' ' VAL . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m . . . . . 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.665 0.269 . . . . 0.0 110.871 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.846 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.788 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.788 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.664 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.846 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.604 HG11 ' OE1' ' A' ' 39' ' ' GLU . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.782 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.604 ' OE1' HG11 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.782 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.743 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.895 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.581 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.87 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.672 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.66 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.87 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.762 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.822 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.425 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.429 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m . . . . . 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.499 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 41.3 mtp . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.791 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.537 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.729 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.784 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.783 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.886 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.886 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.901 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.56 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.901 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.717 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.893 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.636 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.636 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.893 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.747 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.791 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.532 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.537 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m . . . . . 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.0 mtp . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.508 0.194 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.764 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.796 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 ' CB ' ' A' ' 60' ' ' CYS . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.957 ' HA ' HD12 ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.753 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.86 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.567 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.86 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.704 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.875 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.742 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.774 ' HE2' HD21 ' A' ' 41' ' ' LEU . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.466 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.432 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.553 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m . . . . . 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.662 0.268 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.732 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.807 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.602 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.807 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.533 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.487 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.863 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.619 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.863 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.763 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.876 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.732 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.876 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.651 ' HD2' HD23 ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.713 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.861 ' CE2' HD11 ' A' ' 41' ' ' LEU . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m . . . . . 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.526 ' HE2' ' HB3' ' A' ' 24' ' ' MET . 9.9 mtp . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.778 0.323 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.748 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.625 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.779 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.748 ' HA ' ' O ' ' A' ' 25' ' ' MET . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.679 HG11 ' OE1' ' A' ' 39' ' ' GLU . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.406 ' N ' ' HE3' ' A' ' 24' ' ' MET . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.766 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 40' ' ' ASN . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.679 ' OE1' HG11 ' A' ' 34' ' ' VAL . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.782 HD21 ' HE2' ' A' ' 58' ' ' TYR . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.766 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.894 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.894 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.712 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.83 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.678 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.678 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.83 HG21 HD13 ' A' ' 52' ' ' LEU . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.763 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.782 ' HE2' HD21 ' A' ' 41' ' ' LEU . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.458 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 92.8 mtp . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.724 0.297 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 25' ' ' MET . . . . . 0.811 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.725 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.565 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.773 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.532 HG11 ' OE1' ' A' ' 39' ' ' GLU . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.849 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.849 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.992 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.992 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.705 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.894 HD13 HG21 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.894 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.775 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.811 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.487 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.42 -0.272 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -1' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 81.4 p -79.81 -35.18 38.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.786 0.327 . . . . 0.0 110.836 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.05 29.64 17.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.973 0.416 . . . . 0.0 111.133 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' -1' ' ' SER . 3.2 mmtt -123.1 -172.24 2.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 172.5 -18.98 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.573 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 54.5 176.97 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.892 0.377 . . . . 0.0 111.252 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.418 ' HB3' ' CG ' ' A' ' 12' ' ' ASP . 45.6 m-85 -144.91 148.49 33.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.413 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.685 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -55.82 131.58 72.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.672 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.623 ' HD2' HG13 ' A' ' 34' ' ' VAL . 59.1 Cg_endo -74.09 -3.68 14.19 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.517 2.811 . . . . 0.0 114.006 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.724 HD12 ' SG ' ' A' ' 38' ' ' CYS . 0.1 OUTLIER -95.23 -50.83 4.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 179.731 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 p -155.64 -48.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.973 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.737 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 3.4 p-10 50.66 41.44 25.89 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.65 -102.04 0.12 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.72 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.7 t -175.4 100.23 0.08 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.573 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 79.13 -42.1 0.28 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.697 0.761 . . . . 0.0 110.461 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.6 OUTLIER 59.69 85.12 0.11 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.291 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.75 -3.97 58.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.911 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.599 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 22.3 p-10 -125.83 47.53 2.22 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.099 0.475 . . . . 0.0 110.381 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.844 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 6.4 m-20 -65.68 -13.16 58.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.551 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 7.2 p90 -70.1 -38.31 75.6 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.763 0.792 . . . . 0.0 109.945 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.44 -6.02 21.08 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.093 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.844 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 31.6 m -74.27 99.25 3.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.615 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.7 OUTLIER -54.81 90.3 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.198 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.523 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 5.7 mtp -113.49 156.98 22.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.331 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.744 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.706 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.744 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.623 HG13 ' HD2' ' A' ' 9' ' ' PRO . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.737 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.813 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.724 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.814 HD11 ' CE2' ' A' ' 58' ' ' TYR . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.79 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.906 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.655 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.906 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.641 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.793 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.666 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.793 HG21 HD13 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.701 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.814 ' CE2' HD11 ' A' ' 41' ' ' LEU . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.497 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.55 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m -69.09 -39.17 79.19 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.2 -10.34 59.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.916 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 -167.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.827 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.29 76.72 0.36 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 -179.571 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 CA-C-O 120.515 -0.047 . . . . 0.0 113.035 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.2 -27.52 8.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.767 0.318 . . . . 0.0 110.64 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.33 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.043 0.449 . . . . 0.0 110.944 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -132.85 -28.43 1.57 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.068 -179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.448 ' C ' HH11 ' A' ' 32' ' ' ARG . . . -82.63 47.89 3.87 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.131 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 1.033 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 1.7 m-20 -67.51 100.01 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.815 0.34 . . . . 0.0 111.527 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -166.59 157.67 12.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.842 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.771 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.8 t -56.43 116.71 13.56 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.167 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.903 ' HD2' HG13 ' A' ' 34' ' ' VAL . 53.7 Cg_endo -70.04 -3.79 12.91 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.877 2.385 . . . . 0.0 112.671 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 38' ' ' CYS . 10.1 mt -91.71 -49.92 6.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.772 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.3 p -156.17 -43.7 0.08 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.736 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 3.1 p30 49.8 22.18 0.79 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.569 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 1.059 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.5 OUTLIER 59.0 144.86 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.402 0.62 . . . . 0.0 110.588 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.8 OUTLIER -67.06 90.68 0.2 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.683 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.616 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 3.8 m-85 78.63 -38.87 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.521 0.677 . . . . 0.0 110.367 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 1.059 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 18.7 t0 43.13 95.2 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.37 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.89 -4.69 45.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.572 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.71 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.2 p30 -111.66 38.62 2.57 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.979 0.419 . . . . 0.0 110.927 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.905 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 0.3 OUTLIER -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.413 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.71 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 18.7 p90 -70.62 -41.61 72.02 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.983 0.896 . . . . 0.0 109.658 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -97.21 -3.83 40.11 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.027 -1.442 . . . . 0.0 109.947 179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.905 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -68.06 100.57 1.01 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.254 0.55 . . . . 0.0 110.017 179.703 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.546 ' HB3' ' OG ' ' A' ' 36' ' ' SER . 0.0 OUTLIER -58.41 86.1 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.633 -179.468 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 22' ' ' SER . 73.9 mtp -116.37 159.08 22.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.802 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.728 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.796 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 1.033 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.728 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.903 HG13 ' HD2' ' A' ' 9' ' ' PRO . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.771 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.741 ' HB3' HD12 ' A' ' 10' ' ' LEU . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.803 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.724 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.89 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.727 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.685 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.848 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.693 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.436 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.557 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m -69.05 -39.36 79.19 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 24.5 p -74.73 -8.66 57.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.323 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 46.96 -170.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.645 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -165.71 121.47 1.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.1 m -150.47 105.22 3.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 110.964 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.62 156.26 42.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt 62.34 -172.59 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.63 127.02 1.69 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.576 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -162.72 106.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.925 0.393 . . . . 0.0 111.053 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.668 ' HE1' ' HA ' ' A' ' 15' ' ' TYR . 45.8 m-85 -146.46 115.62 7.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.655 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.656 ' H ' ' HB2' ' A' ' 12' ' ' ASP . 0.5 OUTLIER -59.73 179.74 0.19 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.069 179.231 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.921 ' O ' HD23 ' A' ' 10' ' ' LEU . 73.6 Cg_endo -99.39 13.83 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.927 3.085 . . . . 0.0 114.835 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.921 HD23 ' O ' ' A' ' 9' ' ' PRO . 2.2 mt -136.71 -57.91 0.73 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.125 0.488 . . . . 0.0 110.758 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 p -136.04 -67.87 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.612 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.813 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 38.7 t70 69.06 44.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.365 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.719 ' CD ' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER 46.49 18.88 0.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.309 179.151 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 4.5 m 56.79 104.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.668 ' HA ' ' HE1' ' A' ' 7' ' ' PHE . 11.3 m-85 80.08 -39.25 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.467 0.651 . . . . 0.0 111.205 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.719 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 44.2 t0 47.22 96.96 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.253 -0.885 . . . . 0.0 112.387 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.69 ' H ' ' HE2' ' A' ' 13' ' ' LYS . 1.1 m-20 -99.73 -6.51 26.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.654 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.639 ' O ' ' HB2' ' A' ' 22' ' ' SER . 1.0 OUTLIER -133.85 46.5 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.214 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.623 ' HB2' ' HG3' ' A' ' 24' ' ' MET . 9.3 p-10 -64.97 -13.58 57.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.87 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 2.9 p90 -69.67 -37.43 76.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.73 0.776 . . . . 0.0 109.972 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -111.29 -5.79 14.62 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.322 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.1 OUTLIER -75.63 10.44 1.73 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.286 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.575 ' CG ' ' HB3' ' A' ' 36' ' ' SER . 3.7 tptt 59.0 65.83 1.15 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.359 . . . . 0.0 111.154 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.678 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm -108.33 151.38 26.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.791 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.74 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.74 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.502 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 39' ' ' GLU . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.762 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.656 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.543 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.928 HD11 ' CE2' ' A' ' 58' ' ' TYR . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.662 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.789 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.652 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 45' ' ' MET . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.714 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.921 HD13 HG21 ' A' ' 56' ' ' VAL . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.711 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.921 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.715 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.928 ' CE2' HD11 ' A' ' 41' ' ' LEU . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.486 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.458 ' O ' ' HB ' ' A' ' 64' ' ' THR . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG22 ' OE1' ' A' ' 65' ' ' GLU . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.483 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m -69.39 -39.84 77.76 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.458 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.42 -5.03 42.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.954 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' OE1' HG22 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -65.32 138.91 58.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.743 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -79.05 -72.72 0.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.128 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.773 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.137 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.7 p -153.17 36.9 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 0.0 110.832 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.46 146.99 50.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.74 -175.33 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.015 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.83 132.48 3.47 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.447 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 7' ' ' PHE . 23.7 p30 -160.2 92.51 1.0 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.735 0.302 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.455 ' HD1' ' OD2' ' A' ' 12' ' ' ASP . 86.0 m-85 -158.03 137.75 12.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.143 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.773 ' N ' ' HE3' ' A' ' 24' ' ' MET . 0.3 OUTLIER -54.73 122.15 38.32 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.37 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.739 ' HD2' HG13 ' A' ' 34' ' ' VAL . 38.1 Cg_endo -67.95 -3.87 11.36 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.276 2.65 . . . . 0.0 112.756 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.717 HD12 ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -92.17 -53.23 4.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.875 179.365 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.8 p -156.64 -54.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.592 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 54.2 t0 64.98 47.61 2.52 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.768 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.79 -93.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.006 0.431 . . . . 0.0 110.587 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.24 69.69 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.79 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.614 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 26.5 m-85 78.46 -44.98 0.39 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.459 0.647 . . . . 0.0 110.688 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.23 167.79 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.22 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -101.58 -5.48 25.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.29 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 16.7 p30 -160.43 64.05 0.32 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.915 0.388 . . . . 0.0 110.46 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.415 ' HA ' ' CB ' ' A' ' 22' ' ' SER . 2.9 p-10 -65.73 -14.67 61.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.573 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.577 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.7 p90 -70.53 -41.84 72.0 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 109.845 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -103.92 0.12 29.7 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.524 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.415 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 39.2 p -70.48 26.53 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.577 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.1 OUTLIER 59.59 72.92 0.5 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.05 0.452 . . . . 0.0 110.719 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.773 ' HE3' ' N ' ' A' ' 8' ' ' CYS . 98.8 mtp -134.32 156.99 47.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.548 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.685 ' HG2' ' CG ' ' A' ' 58' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.722 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.722 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' ' 9' ' ' PRO . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.769 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.817 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.544 ' HB3' ' CG ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.817 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.912 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.912 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.842 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.866 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.689 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.689 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.866 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.718 ' HE2' HD21 ' A' ' 41' ' ' LEU . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.528 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HG13 ' A' ' 61' ' ' VAL . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m -68.76 -40.05 79.94 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.528 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 3.9 p -75.57 -12.77 60.29 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.652 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 47.21 97.6 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.727 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.57 ' HG2' ' H ' ' A' ' 67' ' ' HIS . 9.6 ttm180 61.74 168.51 0.11 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.905 0.383 . . . . 0.0 111.003 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.57 ' H ' ' HG2' ' A' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.923 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.686 -0.166 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 26.3 t 61.32 82.63 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 0.0 110.81 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.91 -170.18 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -31.39 62.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.114 0.483 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.465 ' HA2' ' CG ' ' A' ' 32' ' ' ARG . . . 80.95 -154.44 35.51 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.687 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.886 ' HA ' ' HB2' ' A' ' 33' ' ' TRP . 20.0 t-20 62.24 83.64 0.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.786 0.327 . . . . 0.0 111.174 179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' CD2' ' O ' ' A' ' 6' ' ' ASN . 7.1 m-85 -170.86 107.85 0.29 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.126 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.763 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 2.0 t -59.78 118.32 30.86 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.876 ' HD2' HG13 ' A' ' 34' ' ' VAL . 39.5 Cg_endo -68.94 -4.92 14.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.996 2.464 . . . . 0.0 112.844 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.725 HD12 ' HB3' ' A' ' 38' ' ' CYS . 10.7 mt -91.98 -50.22 5.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.5 p -156.16 -45.1 0.08 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.012 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 1.9 p30 52.33 16.4 0.59 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.242 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.884 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 59.65 144.91 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.255 0.55 . . . . 0.0 111.081 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.642 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.8 t -72.48 71.33 0.94 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.726 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.642 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 39.9 m-85 80.16 -47.26 0.32 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.42 0.628 . . . . 0.0 109.875 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 31.6 t0 62.76 -7.6 0.14 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.484 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.473 ' H ' ' C ' ' A' ' 15' ' ' TYR . 3.0 t70 62.91 -2.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.544 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.3 m-20 -146.23 54.35 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.318 . . . . 0.0 111.279 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 22' ' ' SER . 31.8 m-20 -67.37 -15.18 63.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.909 0.385 . . . . 0.0 111.35 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 22.2 p90 -71.76 -45.13 62.68 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.809 0.814 . . . . 0.0 108.982 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' OE1' ' HE1' ' A' ' 20' ' ' TYR . 1.3 mt-10 -82.4 -5.56 58.72 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.485 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 3.6 m -67.59 99.88 0.82 Allowed 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.971 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.671 ' HG2' ' OG ' ' A' ' 36' ' ' SER . 1.9 tptm -51.69 89.0 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.964 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp -124.21 165.49 17.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.846 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.788 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.788 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.664 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.886 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.876 HG13 ' HD2' ' A' ' 9' ' ' PRO . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.763 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.782 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.725 ' HB3' HD12 ' A' ' 10' ' ' LEU . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.604 ' OE1' HG11 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.782 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.743 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.895 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.581 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.87 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.672 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.66 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.87 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.762 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.822 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.425 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.432 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m -68.97 -39.66 79.32 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.65 0.37 17.84 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.02 179.451 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 7.1 0.55 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 64' ' ' THR . 13.4 ttm180 -166.05 120.42 1.17 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 0.0 110.459 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.3 p -143.01 139.66 30.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.835 0.35 . . . . 0.0 110.968 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 49.55 97.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.41 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -116.35 159.32 22.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 0.0 111.122 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.56 -138.02 13.92 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.912 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.783 ' H ' ' HG3' ' A' ' 32' ' ' ARG . 21.9 m-80 64.96 58.79 0.9 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.319 0.581 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.755 ' HA ' ' CE ' ' A' ' 24' ' ' MET . 33.2 m-85 -156.87 167.77 29.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.203 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.753 ' HB3' ' CA ' ' A' ' 12' ' ' ASP . 13.6 t -60.92 117.84 29.54 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.826 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.551 ' HD2' HG13 ' A' ' 34' ' ' VAL . 43.2 Cg_endo -68.51 -6.03 16.66 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.198 2.599 . . . . 0.0 112.559 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.02 -49.4 6.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.79 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 p -156.1 -42.48 0.08 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.851 0.358 . . . . 0.0 111.412 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.753 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.9 p30 50.74 22.06 1.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.566 -179.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HD3' ' CG ' ' A' ' 16' ' ' ASP . 0.8 OUTLIER 67.45 -19.91 0.12 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.868 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.9 OUTLIER 62.02 124.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 179.322 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 19.6 m-85 82.5 -26.04 0.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.413 0.625 . . . . 0.0 111.08 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.57 ' CG ' ' HD3' ' A' ' 13' ' ' LYS . 4.5 t0 -38.93 100.23 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.936 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.84 -5.4 59.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.314 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.464 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 46.5 m-20 -104.6 35.54 2.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.931 0.396 . . . . 0.0 110.741 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.616 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 13.5 p-10 -65.19 -15.13 62.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.926 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 4.8 p90 -69.96 -40.36 75.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.704 0.764 . . . . 0.0 109.662 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -105.05 -3.82 22.71 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.343 178.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.522 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 5.5 t -69.54 11.69 0.24 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.699 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' SER . 1.1 tptt 63.53 65.76 0.73 Allowed 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.795 0.331 . . . . 0.0 111.276 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.755 ' CE ' ' HA ' ' A' ' 7' ' ' PHE . 41.3 mtp -123.02 161.85 23.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.242 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.791 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.537 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.729 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.784 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.783 ' HG3' ' H ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.783 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.551 HG13 ' HD2' ' A' ' 9' ' ' PRO . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.681 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.886 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.886 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.901 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.56 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.901 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.717 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.893 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.636 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.636 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.893 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.747 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.791 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.532 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.524 HG12 ' HG3' ' A' ' 9' ' ' PRO . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.537 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m -68.72 -40.01 80.13 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -3.84 36.5 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 96.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.694 0.283 . . . . 0.0 110.873 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.561 ' CB ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -168.25 -56.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.969 0.414 . . . . 0.0 110.907 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.9 p80 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.679 -179.832 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 11.3 p -156.62 -72.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 111.234 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.85 158.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.97 0.414 . . . . 0.0 111.105 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -100.01 166.63 10.95 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.734 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 32' ' ' ARG . . . -169.93 154.44 23.42 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.099 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.944 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 12.9 p30 -168.3 94.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.465 178.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -163.4 160.07 23.06 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.6 t -58.96 115.81 13.32 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.931 ' HD2' HG13 ' A' ' 34' ' ' VAL . 55.8 Cg_endo -70.12 -4.02 13.43 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.088 2.525 . . . . 0.0 112.713 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.806 HD12 ' HB3' ' A' ' 38' ' ' CYS . 7.5 mt -91.66 -49.28 6.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.706 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 p -156.34 -43.16 0.07 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.066 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.74 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 2.8 p30 49.23 28.18 2.13 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.48 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.937 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.2 OUTLIER 60.35 139.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.958 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.628 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -73.22 87.22 1.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.376 179.584 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.628 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.9 m-85 77.77 -44.83 0.43 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.492 0.663 . . . . 0.0 110.027 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.937 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 29.1 t0 54.25 167.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.046 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -134.53 -2.93 2.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.374 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.592 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -131.56 47.59 2.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.682 0.277 . . . . 0.0 111.505 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.875 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 3.1 m-20 -65.57 -17.05 64.29 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.961 0.41 . . . . 0.0 111.226 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.592 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 8.8 p90 -70.55 -41.84 71.94 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.704 0.764 . . . . 0.0 109.134 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -91.9 -4.11 55.14 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.901 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.875 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -67.61 98.19 0.67 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.265 0.555 . . . . 0.0 110.467 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 85.85 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.558 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.457 ' HE3' ' H ' ' A' ' 8' ' ' CYS . 91.0 mtp -111.91 159.22 18.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.263 . . . . 0.0 110.747 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.764 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.796 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.944 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.931 HG13 ' HD2' ' A' ' 9' ' ' PRO . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.957 ' HA ' HD12 ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.806 ' HB3' HD12 ' A' ' 10' ' ' LEU . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.753 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.86 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.567 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.86 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.704 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.875 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.742 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.774 ' HE2' HD21 ' A' ' 41' ' ' LEU . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.466 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.432 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' CG2' ' HA ' ' A' ' 66' ' ' ARG . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.553 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m -68.79 -41.11 79.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.722 HG22 ' N ' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -76.66 -75.83 0.18 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.476 -179.563 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.722 ' N ' HG22 ' A' ' 64' ' ' THR . 3.0 pt-20 -175.64 126.38 0.23 Allowed 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.782 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.433 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . 0.6 OUTLIER -74.81 -9.01 58.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.427 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.711 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.1 t -138.92 141.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 0.0 110.948 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.71 105.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.997 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.614 ' HE3' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -135.24 96.85 3.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.687 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.04 -100.79 2.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.143 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.719 ' OD1' ' HA ' ' A' ' 32' ' ' ARG . 0.6 OUTLIER 69.2 142.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.98 0.419 . . . . 0.0 110.868 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 1.7 p90 -163.85 150.08 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.763 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.77 152.36 19.75 Favored Pre-proline 0 N--CA 1.448 -0.538 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.633 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.94 ' HG2' HG12 ' A' ' 61' ' ' VAL . 9.2 Cg_endo -88.28 1.23 6.59 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 124.271 3.314 . . . . 0.0 114.542 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.7 HD12 ' SG ' ' A' ' 38' ' ' CYS . 0.2 OUTLIER -106.48 -59.86 1.74 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.082 0.468 . . . . 0.0 110.811 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.2 p -139.48 -51.98 0.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.813 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 5.0 p-10 47.8 28.49 1.35 Allowed 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.197 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.954 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 60.09 140.19 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.902 178.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.652 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 6.8 t -70.62 72.78 0.53 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.324 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.652 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 23.1 m-85 83.69 -39.91 0.08 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.553 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.887 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 2.4 p30 49.41 177.45 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.896 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.72 -7.07 3.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.423 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.749 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 2.4 p30 -123.3 43.77 2.86 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.059 0.457 . . . . 0.0 110.642 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 1.5 p30 -65.43 -17.58 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.749 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 16.5 p90 -69.84 -53.09 19.75 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.847 0.832 . . . . 0.0 109.809 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.648 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 5.0 pt-20 -84.64 -0.95 55.26 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.89 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.554 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 1.4 m -67.57 97.87 0.63 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.925 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 36' ' ' SER . 8.2 tptm -52.83 90.46 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.476 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp -109.5 161.8 14.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.205 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.732 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.807 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.602 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.807 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.719 ' HA ' ' OD1' ' A' ' 6' ' ' ASN . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.65 HG13 ' CD ' ' A' ' 9' ' ' PRO . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.863 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.7 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.619 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.863 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.763 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.876 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.732 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.876 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.651 ' HD2' HD23 ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.713 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.861 ' CE2' HD11 ' A' ' 41' ' ' LEU . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.52 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.94 HG12 ' HG2' ' A' ' 9' ' ' PRO . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m -69.58 -39.7 77.18 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.52 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.05 -10.46 59.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.045 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 56.71 167.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.397 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 62.94 162.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.952 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.514 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 CA-C-O 120.286 -0.175 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.53 84.14 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.981 0.419 . . . . 0.0 110.898 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.51 174.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.9 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -165.53 121.9 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.68 132.3 3.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.007 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.767 ' HB3' ' H ' ' A' ' 33' ' ' TRP . 2.5 m-20 63.04 106.36 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.947 0.403 . . . . 0.0 111.086 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -170.8 151.75 3.52 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.372 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.775 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 7.6 t -59.23 115.85 13.77 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.791 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.891 ' HD2' HG13 ' A' ' 34' ' ' VAL . 56.2 Cg_endo -70.73 -3.28 12.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.776 2.318 . . . . 0.0 112.755 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.669 HD12 ' HB3' ' A' ' 38' ' ' CYS . 11.5 mt -91.89 -49.48 6.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.734 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.2 p -156.19 -41.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.728 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 p30 49.11 26.53 1.46 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.689 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 62.96 -1.41 0.49 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.478 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.7 OUTLIER 79.98 103.34 0.07 Allowed 'General case' 0 N--CA 1.462 0.126 0 O-C-N 122.377 -0.202 . . . . 0.0 110.844 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.651 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 81.28 -42.56 0.17 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.386 0.612 . . . . 0.0 110.883 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 t0 53.17 93.83 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.36 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -93.77 -5.76 47.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.907 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.735 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 6.9 p-10 -141.6 47.19 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.107 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.484 ' HA ' ' CB ' ' A' ' 22' ' ' SER . 2.7 p30 -65.08 -14.26 60.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.965 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.735 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.3 p90 -69.78 -40.54 75.99 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.644 0.735 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.418 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.3 pt-20 -106.6 -5.07 18.95 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.516 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 3.3 t -71.27 5.92 1.97 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.363 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.44 58.11 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.551 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.565 ' HE3' ' HB2' ' A' ' 8' ' ' CYS . 9.9 mtp -109.84 160.65 16.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.51 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.748 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.625 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.779 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.571 ' CB ' ' HA ' ' A' ' 6' ' ' ASN . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.767 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.891 HG13 ' HD2' ' A' ' 9' ' ' PRO . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.775 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.766 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.669 ' HB3' HD12 ' A' ' 10' ' ' LEU . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.679 ' OE1' HG11 ' A' ' 34' ' ' VAL . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.782 HD21 ' HE2' ' A' ' 58' ' ' TYR . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.766 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.894 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.894 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.712 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.83 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.678 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.678 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.83 HG21 HD13 ' A' ' 52' ' ' LEU . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.763 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.782 ' HE2' HD21 ' A' ' 41' ' ' LEU . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.458 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.436 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m -68.67 -40.87 79.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -73.93 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.194 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' THR . 2.7 mt-10 75.31 99.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.721 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -78.32 -58.09 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.825 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 35.7 p-80 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.909 179.987 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.6 m 59.28 91.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.928 0.394 . . . . 0.0 111.189 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.54 -30.24 0.55 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.237 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.11 175.15 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.332 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 142.77 82.74 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.17 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.401 ' ND2' ' CD1' ' A' ' 33' ' ' TRP . 8.5 m120 -74.62 109.18 7.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.702 0.287 . . . . 0.0 110.768 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.573 ' HA ' ' OD2' ' A' ' 12' ' ' ASP . 0.2 OUTLIER -161.82 113.59 1.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.919 0.39 . . . . 0.0 111.714 -179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.83 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.59 163.91 1.75 Allowed Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.88 ' CD ' HG13 ' A' ' 34' ' ' VAL . 23.7 Cg_endo -94.9 -0.14 2.65 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.054 3.169 . . . . 0.0 115.009 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.662 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -111.68 -53.35 2.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.293 0.568 . . . . 0.0 110.423 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -143.34 -65.56 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.044 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.782 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 35.1 t70 68.26 37.13 2.89 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.927 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 16' ' ' ASP . 0.0 OUTLIER 62.3 144.81 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.436 179.723 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -68.95 91.64 0.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.745 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.659 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 10.7 m-85 81.38 -39.21 0.13 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.502 0.668 . . . . 0.0 109.608 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 1.052 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 6.9 p-10 44.41 101.5 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.536 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -89.01 -4.21 58.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.788 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.879 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 62.2 m-20 -116.24 41.66 2.57 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.08 0.467 . . . . 0.0 111.13 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.596 ' HA ' ' OG ' ' A' ' 22' ' ' SER . 6.7 t70 -65.5 -14.79 61.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.311 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.879 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 9.1 p90 -70.17 -40.87 74.42 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.735 0.779 . . . . 0.0 109.367 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -96.72 -3.22 42.9 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.905 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.596 ' OG ' ' HA ' ' A' ' 19' ' ' ASP . 58.8 m -67.67 97.75 0.64 Allowed 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.537 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 85.6 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.579 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.604 ' HE3' ' H ' ' A' ' 8' ' ' CYS . 92.8 mtp -115.16 163.74 15.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.751 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' MET . . . . . 0.811 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.725 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.565 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.773 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.88 HG13 ' CD ' ' A' ' 9' ' ' PRO . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . 0.83 ' H ' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.849 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.56 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.849 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.992 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.992 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.705 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.894 HD13 HG21 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.894 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.775 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.811 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.487 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.543 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.79 HG12 ' HG2' ' A' ' 9' ' ' PRO . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m -69.14 -39.8 78.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.543 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.33 -7.97 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.068 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 45.69 101.34 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 112.128 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.84 -14.54 61.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.001 179.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.078 0 CA-C-O 120.714 0.292 . . . . 0.0 110.731 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 5.7 mtp . . . . . 0 C--O 1.228 -0.04 0 N-CA-C 110.331 -0.248 . . . . 0.0 110.331 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.744 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.706 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.744 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.513 HG11 ' OE2' ' A' ' 39' ' ' GLU . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.813 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.814 HD11 ' CE2' ' A' ' 58' ' ' TYR . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.79 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.906 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.655 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.906 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.641 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.793 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.666 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.793 HG21 HD13 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.701 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.814 ' CE2' HD11 ' A' ' 41' ' ' LEU . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.497 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m . . . . . 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 73.9 mtp . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.849 0.357 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.728 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.796 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.796 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.728 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.43 ' C ' ' H ' ' A' ' 40' ' ' ASN . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.803 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.724 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.89 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.727 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.685 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.848 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.693 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.436 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.678 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.791 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.74 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.74 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.502 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 39' ' ' GLU . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.762 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.543 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.928 HD11 ' CE2' ' A' ' 58' ' ' TYR . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.662 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.789 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.652 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 45' ' ' MET . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.714 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.921 HD13 HG21 ' A' ' 56' ' ' VAL . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.711 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.921 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.715 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.928 ' CE2' HD11 ' A' ' 41' ' ' LEU . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.486 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.483 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m . . . . . 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.53 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 98.8 mtp . . . . . 0 CA--C 1.523 -0.067 0 CA-C-O 120.726 0.298 . . . . 0.0 110.548 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.685 ' HG2' ' CG ' ' A' ' 58' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.722 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.722 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.61 HG11 ' OE1' ' A' ' 39' ' ' GLU . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.544 ' CG ' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.817 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.544 ' HB3' ' CG ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.817 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.912 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.912 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.842 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.671 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.866 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.689 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.689 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.866 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.718 ' HE2' HD21 ' A' ' 41' ' ' LEU . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.403 HG13 ' N ' ' A' ' 62' ' ' ASN . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HG13 ' A' ' 61' ' ' VAL . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m . . . . . 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp . . . . . 0 CA--C 1.528 0.1 0 CA-C-O 120.665 0.269 . . . . 0.0 110.871 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.846 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.788 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.788 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.664 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.846 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.604 HG11 ' OE1' ' A' ' 39' ' ' GLU . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.782 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.604 ' OE1' HG11 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.782 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.743 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.895 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.581 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.87 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.672 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.66 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.87 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.762 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.822 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.425 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.429 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m . . . . . 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.499 ' HG2' ' HA ' ' A' ' 35' ' ' HIS . 41.3 mtp . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 120.828 0.347 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.791 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.537 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.729 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.784 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.729 ' HE ' ' HB2' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.783 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.886 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.886 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.901 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.56 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.901 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.717 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.893 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.636 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.636 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.893 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.747 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.791 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.532 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.537 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m . . . . . 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.0 mtp . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 120.508 0.194 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.764 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.796 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 ' CB ' ' A' ' 60' ' ' CYS . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.957 ' HA ' HD12 ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.753 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.86 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.567 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.86 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.704 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.875 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.742 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.774 ' HE2' HD21 ' A' ' 41' ' ' LEU . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.466 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.432 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.553 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m . . . . . 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.662 0.268 . . . . 0.0 111.205 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.732 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.807 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.602 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.807 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.533 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.487 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.863 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.487 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.619 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.863 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.763 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.876 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.732 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.876 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.651 ' HD2' HD23 ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.713 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.861 ' CE2' HD11 ' A' ' 41' ' ' LEU . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m . . . . . 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.526 ' HE2' ' HB3' ' A' ' 24' ' ' MET . 9.9 mtp . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.778 0.323 . . . . 0.0 110.51 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.748 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.625 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.779 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.748 ' HA ' ' O ' ' A' ' 25' ' ' MET . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.679 HG11 ' OE1' ' A' ' 39' ' ' GLU . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.406 ' N ' ' HE3' ' A' ' 24' ' ' MET . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.766 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 40' ' ' ASN . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.679 ' OE1' HG11 ' A' ' 34' ' ' VAL . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.782 HD21 ' HE2' ' A' ' 58' ' ' TYR . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.766 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.894 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.894 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.712 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.83 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.678 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.678 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.83 HG21 HD13 ' A' ' 52' ' ' LEU . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.763 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.782 ' HE2' HD21 ' A' ' 41' ' ' LEU . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.458 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 92.8 mtp . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.724 0.297 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' MET . . . . . 0.811 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.725 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.565 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.773 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.532 HG11 ' OE1' ' A' ' 39' ' ' GLU . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.849 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.476 ' HB3' ' HB3' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.849 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.992 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.992 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.705 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.894 HD13 HG21 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.894 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.775 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.811 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.487 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m . . . . . 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.286 0 N-CA-C 112.42 -0.272 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . 0.421 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 81.4 p -79.81 -35.18 38.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.786 0.327 . . . . 0.0 110.836 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.05 29.64 17.7 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.973 0.416 . . . . 0.0 111.133 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' -1' ' ' SER . 3.2 mmtt -123.1 -172.24 2.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.79 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 172.5 -18.98 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.573 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.6 m-20 54.5 176.97 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.892 0.377 . . . . 0.0 111.252 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.418 ' HB3' ' CG ' ' A' ' 12' ' ' ASP . 45.6 m-85 -144.91 148.49 33.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.413 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.685 ' HB3' ' HB3' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -55.82 131.58 72.81 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.672 179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.623 ' HD2' HG13 ' A' ' 34' ' ' VAL . 59.1 Cg_endo -74.09 -3.68 14.19 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 123.517 2.811 . . . . 0.0 114.006 -178.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.724 HD12 ' SG ' ' A' ' 38' ' ' CYS . 0.1 OUTLIER -95.23 -50.83 4.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 0.0 110.455 179.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 p -155.64 -48.54 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.973 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.737 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 3.4 p-10 50.66 41.44 25.89 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.674 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.65 -102.04 0.12 Allowed 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.72 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.647 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.7 t -175.4 100.23 0.08 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.573 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 79.13 -42.1 0.28 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.697 0.761 . . . . 0.0 110.461 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.471 ' HB3' ' OD2' ' A' ' 19' ' ' ASP . 0.6 OUTLIER 59.69 85.12 0.11 Allowed 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.291 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.75 -3.97 58.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.911 179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.599 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 22.3 p-10 -125.83 47.53 2.22 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 121.099 0.475 . . . . 0.0 110.381 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.844 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 6.4 m-20 -65.68 -13.16 58.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.551 -179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.599 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 7.2 p90 -70.1 -38.31 75.6 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.763 0.792 . . . . 0.0 109.945 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.44 -6.02 21.08 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.093 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.844 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 31.6 m -74.27 99.25 3.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.615 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.586 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.7 OUTLIER -54.81 90.3 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.198 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.523 ' HE1' ' O ' ' A' ' 33' ' ' TRP . 5.7 mtp -113.49 156.98 22.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.331 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.744 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -109.84 130.53 55.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.876 0.369 . . . . 0.0 111.922 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -87.63 109.48 19.69 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.956 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 53.7 t -60.47 157.03 14.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.201 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.07 -19.12 20.16 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.182 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.527 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.05 -56.28 3.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 -179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.507 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.4 p -110.93 0.69 17.18 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.955 0.407 . . . . 0.0 111.249 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.706 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 60.82 17.48 7.75 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.793 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.507 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.0 OUTLIER -73.53 142.81 46.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.052 0.453 . . . . 0.0 110.751 179.642 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.744 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.1 m95 -87.45 121.83 30.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.983 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.623 HG13 ' HD2' ' A' ' 9' ' ' PRO . 2.8 t -111.04 145.88 16.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.737 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.61 120.04 9.25 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.902 0.382 . . . . 0.0 110.897 -179.029 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.813 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 3.6 t -60.15 -48.76 80.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.194 0.521 . . . . 0.0 110.681 179.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -78.0 -48.89 15.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.009 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.724 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -62.0 -37.39 84.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.603 -178.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 5.3 tp10 -70.89 3.9 2.97 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 120.672 0.272 . . . . 0.0 111.089 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 68.17 31.32 5.37 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.836 0.35 . . . . 0.0 111.439 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.814 HD11 ' CE2' ' A' ' 58' ' ' TYR . 13.8 mt -83.67 116.55 22.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.828 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.79 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.3 OUTLIER -68.8 147.86 51.14 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 47' ' ' GLU . 15.0 m-20 -63.23 -41.67 99.13 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.041 0.448 . . . . 0.0 112.186 -179.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.412 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.83 -50.42 66.76 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.975 179.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.906 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.84 -35.88 82.54 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 114.551 -1.204 . . . . 0.0 108.822 179.126 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.655 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 3.6 t80 -69.74 -31.52 69.53 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.42 177.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 43' ' ' ASP . 2.7 mm-40 -71.25 -36.28 71.71 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.877 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.906 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.22 -40.6 78.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.074 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.641 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.65 -41.8 75.08 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.561 0.696 . . . . 0.0 109.71 178.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.17 -19.09 63.99 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 114.572 -1.195 . . . . 0.0 112.047 -179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.91 -24.1 18.54 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.051 0.453 . . . . 0.0 110.186 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.793 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.49 162.54 48.91 Favored Pre-proline 0 N--CA 1.445 -0.695 0 CA-C-O 121.554 0.693 . . . . 0.0 110.527 179.047 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.666 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 57.9 Cg_endo -82.46 17.91 1.52 Allowed 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.424 2.749 . . . . 0.0 112.63 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 15.7 mt-10 83.79 10.6 0.46 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.301 0.64 . . . . 0.0 111.632 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 37.8 t -61.0 -34.41 74.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.855 0.36 . . . . 0.0 110.562 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.793 HG21 HD13 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -83.13 -177.97 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.915 0 CA-C-O 121.819 0.819 . . . . 0.0 110.554 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.701 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.96 129.81 16.21 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 113.895 -1.502 . . . . 0.0 110.233 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.814 ' CE2' HD11 ' A' ' 41' ' ' LEU . 28.0 t80 -90.13 119.82 30.79 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.497 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -108.13 131.55 54.52 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.624 -179.208 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.55 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.6 p -75.23 167.19 22.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.77 -178.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.4 p -52.65 -42.1 39.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -44.02 78.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.977 0.418 . . . . 0.0 111.701 -178.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 62.4 m -69.09 -39.17 79.19 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.2 -10.34 59.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.188 -0.914 . . . . 0.0 110.916 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 43.21 -167.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.827 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.29 76.72 0.36 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.059 -179.571 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.355 0 CA-C-O 120.515 -0.047 . . . . 0.0 113.035 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -111.2 -27.52 8.66 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.767 0.318 . . . . 0.0 110.64 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.33 110.39 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.043 0.449 . . . . 0.0 110.944 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.506 ' N ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -132.85 -28.43 1.57 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.068 -179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.448 ' C ' HH11 ' A' ' 32' ' ' ARG . . . -82.63 47.89 3.87 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.131 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 1.033 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 1.7 m-20 -67.51 100.01 0.82 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.815 0.34 . . . . 0.0 111.527 -178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -166.59 157.67 12.65 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.842 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.771 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.8 t -56.43 116.71 13.56 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.167 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.903 ' HD2' HG13 ' A' ' 34' ' ' VAL . 53.7 Cg_endo -70.04 -3.79 12.91 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.877 2.385 . . . . 0.0 112.671 -179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.741 HD12 ' HB3' ' A' ' 38' ' ' CYS . 10.1 mt -91.71 -49.92 6.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.772 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.3 p -156.17 -43.7 0.08 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.736 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 3.1 p30 49.8 22.18 0.79 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.569 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 1.059 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.5 OUTLIER 59.0 144.86 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 121.402 0.62 . . . . 0.0 110.588 179.508 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.8 OUTLIER -67.06 90.68 0.2 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.683 -179.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.616 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 3.8 m-85 78.63 -38.87 0.23 Allowed 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.521 0.677 . . . . 0.0 110.367 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 1.059 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 18.7 t0 43.13 95.2 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.37 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.89 -4.69 45.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.572 178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.71 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.2 p30 -111.66 38.62 2.57 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 120.979 0.419 . . . . 0.0 110.927 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.905 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 0.3 OUTLIER -65.71 -13.71 59.82 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.413 179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.71 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 18.7 p90 -70.62 -41.61 72.02 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.983 0.896 . . . . 0.0 109.658 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -97.21 -3.83 40.11 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.027 -1.442 . . . . 0.0 109.947 179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.905 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -68.06 100.57 1.01 Allowed 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 121.254 0.55 . . . . 0.0 110.017 179.703 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.546 ' HB3' ' OG ' ' A' ' 36' ' ' SER . 0.0 OUTLIER -58.41 86.1 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.231 -0.895 . . . . 0.0 111.633 -179.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 22' ' ' SER . 73.9 mtp -116.37 159.08 22.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.802 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.728 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.8 tpp -110.16 151.06 27.74 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.858 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -95.67 110.34 22.47 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.664 179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.704 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 36.3 t -60.69 156.4 16.91 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.575 0.226 . . . . 0.0 110.512 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.57 -17.31 24.26 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.767 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.606 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.7 -53.32 5.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.654 0.264 . . . . 0.0 110.776 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.796 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.7 p -115.5 3.62 14.09 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 120.824 0.345 . . . . 0.0 111.33 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.704 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 59.4 18.33 6.71 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 179.546 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 1.033 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -70.74 142.15 51.46 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.855 0.359 . . . . 0.0 110.619 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.728 ' HA ' ' O ' ' A' ' 25' ' ' MET . 75.0 m95 -88.38 120.05 29.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.217 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.903 HG13 ' HD2' ' A' ' 9' ' ' PRO . 3.4 t -110.95 140.69 29.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 110.106 -0.331 . . . . 0.0 110.106 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.771 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.81 120.83 10.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.969 0.414 . . . . 0.0 110.352 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.803 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 59.6 p -56.71 -48.51 77.56 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.105 -179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.3 tttt -73.09 -39.64 65.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.831 0.348 . . . . 0.0 111.756 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.741 ' HB3' HD12 ' A' ' 10' ' ' LEU . 67.2 m -65.74 -42.16 91.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.632 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.615 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 3.7 tp10 -74.09 18.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.803 0.335 . . . . 0.0 111.342 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 38' ' ' CYS . 2.6 m-20 56.23 28.45 13.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.807 0.337 . . . . 0.0 111.002 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.803 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.4 mt -81.54 105.25 12.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.219 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.724 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -62.79 148.65 46.25 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 178.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 10.9 m-20 -60.18 -42.78 95.74 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.223 0.535 . . . . 0.0 111.447 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.62 -49.56 72.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.83 0.824 . . . . 0.0 110.063 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.89 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.22 -34.56 78.66 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.902 179.232 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 27.2 t80 -70.38 -31.15 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.498 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.3 mt-10 -72.64 -36.34 68.0 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.602 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.89 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.4 mt -57.54 -40.69 76.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.056 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.727 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.99 -42.12 76.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.97 -0.692 . . . . 0.0 109.487 178.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -69.34 -15.68 63.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.354 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -96.87 -23.99 16.09 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.055 0.455 . . . . 0.0 110.277 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.848 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.25 163.09 34.44 Favored Pre-proline 0 N--CA 1.445 -0.699 0 CA-C-O 121.6 0.714 . . . . 0.0 110.587 178.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.685 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.9 Cg_endo -82.38 14.06 2.38 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.303 2.669 . . . . 0.0 112.735 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.685 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.3 mm-40 85.84 17.28 0.12 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.381 0.672 . . . . 0.0 111.395 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.631 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.848 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.82 -179.82 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.895 0.855 . . . . 0.0 110.357 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.769 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.03 133.44 19.64 Favored 'General case' 0 C--N 1.302 -1.476 0 CA-C-N 113.965 -1.471 . . . . 0.0 109.808 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.693 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 19.5 t80 -99.3 116.08 30.64 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 121.209 0.528 . . . . 0.0 109.671 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.436 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.3 m -107.76 131.47 54.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.071 -179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.6 p -75.56 160.81 29.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.587 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.557 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 5.4 p -53.27 -41.91 45.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -63.42 -43.75 96.57 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 41.5 m -69.05 -39.36 79.19 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.442 0.639 . . . . 0.0 109.404 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.557 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 24.5 p -74.73 -8.66 57.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.323 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 46.96 -170.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.645 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -165.71 121.47 1.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.816 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 1.1 m -150.47 105.22 3.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 110.964 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.62 156.26 42.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt 62.34 -172.59 0.15 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.9 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 147.63 127.02 1.69 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.576 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -162.72 106.72 1.11 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.925 0.393 . . . . 0.0 111.053 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.668 ' HE1' ' HA ' ' A' ' 15' ' ' TYR . 45.8 m-85 -146.46 115.62 7.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.655 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.656 ' H ' ' HB2' ' A' ' 12' ' ' ASP . 0.5 OUTLIER -59.73 179.74 0.19 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.069 179.231 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.921 ' O ' HD23 ' A' ' 10' ' ' LEU . 73.6 Cg_endo -99.39 13.83 0.58 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 123.927 3.085 . . . . 0.0 114.835 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.921 HD23 ' O ' ' A' ' 9' ' ' PRO . 2.2 mt -136.71 -57.91 0.73 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.125 0.488 . . . . 0.0 110.758 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 p -136.04 -67.87 0.51 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.612 -178.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.813 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 38.7 t70 69.06 44.22 1.03 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.024 -0.534 . . . . 0.0 112.365 179.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.719 ' CD ' ' HA ' ' A' ' 16' ' ' ASP . 0.1 OUTLIER 46.49 18.88 0.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.309 179.151 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.612 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 4.5 m 56.79 104.66 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.204 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.668 ' HA ' ' HE1' ' A' ' 7' ' ' PHE . 11.3 m-85 80.08 -39.25 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.467 0.651 . . . . 0.0 111.205 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.719 ' HA ' ' CD ' ' A' ' 13' ' ' LYS . 44.2 t0 47.22 96.96 0.01 OUTLIER 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.253 -0.885 . . . . 0.0 112.387 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.69 ' H ' ' HE2' ' A' ' 13' ' ' LYS . 1.1 m-20 -99.73 -6.51 26.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.654 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.639 ' O ' ' HB2' ' A' ' 22' ' ' SER . 1.0 OUTLIER -133.85 46.5 2.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.214 179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.623 ' HB2' ' HG3' ' A' ' 24' ' ' MET . 9.3 p-10 -64.97 -13.58 57.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.87 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.526 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 2.9 p90 -69.67 -37.43 76.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.73 0.776 . . . . 0.0 109.972 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -111.29 -5.79 14.62 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 114.488 -1.233 . . . . 0.0 110.322 179.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.639 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 0.1 OUTLIER -75.63 10.44 1.73 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.286 179.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.575 ' CG ' ' HB3' ' A' ' 36' ' ' SER . 3.7 tptt 59.0 65.83 1.15 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.855 0.359 . . . . 0.0 111.154 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.678 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 82.1 mmm -108.33 151.38 26.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.012 0.434 . . . . 0.0 111.202 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.791 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 0.0 OUTLIER -108.58 130.52 55.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.563 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.401 ' OE1' ' CZ2' ' A' ' 33' ' ' TRP . 5.4 tt0 -86.36 109.43 19.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.713 179.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.74 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 47.6 t -60.51 158.38 12.34 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.653 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.05 -18.05 20.98 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.537 -0.839 . . . . 0.0 112.105 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.486 ' HD2' ' CG2' ' A' ' 59' ' ' THR . 3.5 mttm -86.69 -58.83 2.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.783 0.325 . . . . 0.0 110.349 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.502 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 28.4 p -108.87 -1.59 19.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.865 0.364 . . . . 0.0 111.232 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.74 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.1 m-20 63.35 15.35 8.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.002 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.502 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 3.4 tpt180 -70.66 144.13 51.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.269 0.557 . . . . 0.0 110.669 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.791 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.5 m95 -86.43 123.92 32.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.675 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 39' ' ' GLU . 18.7 t -111.43 139.52 35.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.071 179.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -60.8 119.88 9.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.228 0.537 . . . . 0.0 110.977 -179.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.762 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 11.5 t -59.98 -47.8 84.33 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.068 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.484 ' HD2' ' HB3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -79.84 -45.69 18.24 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.01 -179.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.656 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -65.39 -39.64 92.47 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.729 -178.682 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.543 ' HB2' HG12 ' A' ' 34' ' ' VAL . 5.4 tp10 -73.73 4.08 5.6 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.526 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 70.65 31.96 2.69 Favored 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 179.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.928 HD11 ' CE2' ' A' ' 58' ' ' TYR . 11.6 mt -83.23 112.01 19.47 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.176 -0.305 . . . . 0.0 110.176 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.662 ' CB ' ' HG2' ' A' ' 45' ' ' MET . 0.7 OUTLIER -63.24 147.88 49.74 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.56 179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.17 -42.51 99.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.946 0.403 . . . . 0.0 112.018 -178.993 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -63.93 -50.42 68.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.609 0.719 . . . . 0.0 109.985 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.789 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.56 -34.82 79.15 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.539 -1.21 . . . . 0.0 108.676 179.284 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.652 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 9.3 t80 -69.54 -31.84 70.28 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.572 177.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ASP . 3.4 mt-10 -71.55 -36.21 70.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.364 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 45' ' ' MET . 4.3 mt -57.96 -38.87 69.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.043 -178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.714 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.84 -40.8 68.79 Favored 'General case' 0 CA--C 1.519 -0.232 0 C-N-CA 119.779 -0.768 . . . . 0.0 109.371 178.301 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.36 -18.82 63.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 114.636 -1.166 . . . . 0.0 112.072 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.4 -23.7 17.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.046 0.45 . . . . 0.0 110.558 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.921 HD13 HG21 ' A' ' 56' ' ' VAL . 0.5 OUTLIER -64.65 162.8 32.44 Favored Pre-proline 0 N--CA 1.447 -0.619 0 CA-C-O 121.758 0.79 . . . . 0.0 110.711 179.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.711 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.5 Cg_endo -81.29 12.8 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.408 2.738 . . . . 0.0 112.793 -179.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.711 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.6 mm-40 87.01 8.19 0.22 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.359 0.664 . . . . 0.0 111.763 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -63.75 -31.01 72.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.921 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.73 -179.78 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-O 121.903 0.858 . . . . 0.0 110.413 179.118 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.715 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.56 16.81 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.031 -1.441 . . . . 0.0 110.335 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.928 ' CE2' HD11 ' A' ' 41' ' ' LEU . 26.0 t80 -90.37 121.33 32.26 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.486 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -108.08 131.75 54.29 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.583 -179.209 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.458 ' O ' ' HB ' ' A' ' 64' ' ' THR . 22.2 p -75.06 159.84 31.22 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.666 -178.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG22 ' OE1' ' A' ' 65' ' ' GLU . 5.8 p -52.09 -42.47 35.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.755 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.449 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 5.4 t-20 -64.46 -43.58 93.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.106 0.479 . . . . 0.0 111.46 -179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.483 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 13.0 m -69.39 -39.84 77.76 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.458 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.42 -5.03 42.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.954 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' OE1' HG22 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -65.32 138.91 58.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.743 179.403 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 30.4 ttt180 -79.05 -72.72 0.37 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.128 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 1.6 t60 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.947 -179.773 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.137 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 51.7 p -153.17 36.9 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.906 0.384 . . . . 0.0 110.832 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -127.46 146.99 50.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.851 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -122.74 -175.33 3.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.015 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.83 132.48 3.47 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.447 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 7' ' ' PHE . 23.7 p30 -160.2 92.51 1.0 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.735 0.302 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.455 ' HD1' ' OD2' ' A' ' 12' ' ' ASP . 86.0 m-85 -158.03 137.75 12.12 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.143 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.773 ' N ' ' HE3' ' A' ' 24' ' ' MET . 0.3 OUTLIER -54.73 122.15 38.32 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.739 ' HD2' HG13 ' A' ' 34' ' ' VAL . 38.1 Cg_endo -67.95 -3.87 11.36 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 123.276 2.65 . . . . 0.0 112.756 -178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.717 HD12 ' SG ' ' A' ' 8' ' ' CYS . 0.6 OUTLIER -92.17 -53.23 4.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.875 179.365 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.8 p -156.64 -54.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.592 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.769 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 54.2 t0 64.98 47.61 2.52 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 115.669 -0.696 . . . . 0.0 112.768 179.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.79 -93.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.006 0.431 . . . . 0.0 110.587 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -176.24 69.69 0.02 OUTLIER 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.79 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.614 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 26.5 m-85 78.46 -44.98 0.39 Allowed 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.459 0.647 . . . . 0.0 110.688 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.23 167.79 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.22 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -101.58 -5.48 25.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.29 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 16.7 p30 -160.43 64.05 0.32 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.915 0.388 . . . . 0.0 110.46 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.415 ' HA ' ' CB ' ' A' ' 22' ' ' SER . 2.9 p-10 -65.73 -14.67 61.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.573 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.577 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.7 p90 -70.53 -41.84 72.0 Favored 'General case' 0 CA--C 1.511 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 109.845 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.3 OUTLIER -103.92 0.12 29.7 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.524 179.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.415 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 39.2 p -70.48 26.53 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.577 ' O ' ' HB3' ' A' ' 36' ' ' SER . 0.1 OUTLIER 59.59 72.92 0.5 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.05 0.452 . . . . 0.0 110.719 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.773 ' HE3' ' N ' ' A' ' 8' ' ' CYS . 98.8 mtp -134.32 156.99 47.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.548 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.685 ' HG2' ' CG ' ' A' ' 58' ' ' TYR . 55.1 tpp -112.63 150.49 31.35 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.108 0.48 . . . . 0.0 112.038 -179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' MET . 7.7 tt0 -93.43 110.59 22.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.591 179.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.722 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 34.5 t -61.32 158.47 14.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.586 0.231 . . . . 0.0 110.61 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.45 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.34 -17.24 20.52 Favored Glycine 0 C--N 1.333 0.414 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.719 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.95 -55.15 3.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.605 0.24 . . . . 0.0 110.458 179.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 29.5 p -107.71 -0.41 21.82 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.864 0.364 . . . . 0.0 110.97 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.722 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.8 OUTLIER 58.22 14.07 2.63 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.27 148.5 39.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.957 0.408 . . . . 0.0 110.816 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.669 ' HA ' ' O ' ' A' ' 25' ' ' MET . 61.9 m95 -86.59 125.35 33.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.498 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' ' 9' ' ' PRO . 21.9 t -110.21 150.91 12.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.966 0.412 . . . . 0.0 110.557 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.769 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -62.79 119.17 8.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.89 -178.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.817 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 7.8 t -62.32 -47.57 83.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 0.0 110.574 178.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.5 ttpt -80.03 -49.79 11.3 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.523 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.544 ' HB3' ' CG ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -62.38 -37.11 84.48 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -178.682 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 7.3 tp10 -72.89 4.0 4.65 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 120.887 0.375 . . . . 0.0 110.758 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 68.93 32.48 3.85 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 179.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.817 ' HB2' ' O ' ' A' ' 36' ' ' SER . 7.2 mt -83.87 107.14 16.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.64 179.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.912 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 1.4 m -61.72 148.19 43.66 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.839 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -60.7 -42.28 96.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.125 0.488 . . . . 0.0 112.043 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.5 -49.69 70.35 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.975 179.811 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.912 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -65.66 -34.32 77.95 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.644 179.49 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 23.7 t80 -70.01 -31.53 69.24 Favored 'General case' 0 N--CA 1.457 -0.103 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.624 177.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -73.33 -36.02 66.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.989 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.842 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.9 mt -57.96 -40.06 74.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.985 -179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.671 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.34 -40.89 77.29 Favored 'General case' 0 CA--C 1.518 -0.268 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.632 178.899 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.3 m -69.55 -16.55 63.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.501 -1.227 . . . . 0.0 111.939 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -97.08 -23.59 16.17 Favored 'General case' 0 C--O 1.23 0.077 0 CA-C-O 121.062 0.458 . . . . 0.0 110.278 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.866 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.26 162.55 39.43 Favored Pre-proline 0 N--CA 1.447 -0.605 0 CA-C-O 121.71 0.766 . . . . 0.0 110.933 179.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.689 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 53.4 Cg_endo -81.79 13.86 2.35 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.502 2.802 . . . . 0.0 112.915 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.689 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 5.0 mt-10 86.08 6.59 0.37 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.204 0.602 . . . . 0.0 111.672 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.3 m -62.39 -30.93 71.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.806 0.336 . . . . 0.0 110.55 179.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.866 HG21 HD13 ' A' ' 52' ' ' LEU . 1.4 t -82.65 175.75 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.125 0 CA-C-O 121.978 0.894 . . . . 0.0 110.506 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.688 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.13 131.07 18.17 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-N 113.857 -1.52 . . . . 0.0 110.193 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.718 ' HE2' HD21 ' A' ' 41' ' ' LEU . 18.7 t80 -94.28 117.87 30.76 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-O 121.107 0.479 . . . . 0.0 109.965 179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.477 HG23 ' HB2' ' A' ' 29' ' ' LYS . 1.5 m -107.97 131.47 54.52 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.573 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 16.5 p -75.1 156.51 35.97 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.236 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.528 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 6.1 p -52.68 -42.11 40.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -177.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.403 ' N ' HG13 ' A' ' 61' ' ' VAL . 3.1 t-20 -63.56 -41.15 98.44 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.353 0.597 . . . . 0.0 111.567 -178.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.5 m -68.76 -40.05 79.94 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.949 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.528 ' OG1' ' HA ' ' A' ' 61' ' ' VAL . 3.9 p -75.57 -12.77 60.29 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.652 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 47.21 97.6 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.727 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.57 ' HG2' ' H ' ' A' ' 67' ' ' HIS . 9.6 ttm180 61.74 168.51 0.11 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.905 0.383 . . . . 0.0 111.003 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.57 ' H ' ' HG2' ' A' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.923 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 N-CA-C 112.686 -0.166 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 26.3 t 61.32 82.63 0.16 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.779 0.323 . . . . 0.0 110.81 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.91 -170.18 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.014 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -31.39 62.91 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.114 0.483 . . . . 0.0 110.714 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.465 ' HA2' ' CG ' ' A' ' 32' ' ' ARG . . . 80.95 -154.44 35.51 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.687 -179.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.886 ' HA ' ' HB2' ' A' ' 33' ' ' TRP . 0.2 OUTLIER 62.24 83.64 0.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 120.786 0.327 . . . . 0.0 111.174 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.526 ' CD2' ' O ' ' A' ' 6' ' ' ASN . 7.1 m-85 -170.86 107.85 0.29 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.126 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.763 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 2.0 t -59.78 118.32 30.86 Favored Pre-proline 0 CA--C 1.535 0.371 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.876 ' HD2' HG13 ' A' ' 34' ' ' VAL . 39.5 Cg_endo -68.94 -4.92 14.43 Favored 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.996 2.464 . . . . 0.0 112.844 -179.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.725 HD12 ' HB3' ' A' ' 38' ' ' CYS . 10.7 mt -91.98 -50.22 5.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.5 p -156.16 -45.1 0.08 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.012 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.697 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 1.9 p30 52.33 16.4 0.59 Allowed 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 112.242 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.884 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 59.65 144.91 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.255 0.55 . . . . 0.0 111.081 179.229 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.642 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 1.8 t -72.48 71.33 0.94 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.726 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.642 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 39.9 m-85 80.16 -47.26 0.32 Allowed 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.42 0.628 . . . . 0.0 109.875 -178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 31.6 t0 62.76 -7.6 0.14 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.484 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.473 ' H ' ' C ' ' A' ' 15' ' ' TYR . 3.0 t70 62.91 -2.49 0.39 Allowed 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.544 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 2.3 m-20 -146.23 54.35 1.14 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.769 0.318 . . . . 0.0 111.279 -179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.501 ' O ' ' HB2' ' A' ' 22' ' ' SER . 31.8 m-20 -67.37 -15.18 63.53 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.909 0.385 . . . . 0.0 111.35 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.544 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 22.2 p90 -71.76 -45.13 62.68 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.809 0.814 . . . . 0.0 108.982 178.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' OE1' ' HE1' ' A' ' 20' ' ' TYR . 1.3 mt-10 -82.4 -5.56 58.72 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.113 -1.403 . . . . 0.0 109.485 178.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 19' ' ' ASP . 3.6 m -67.59 99.88 0.82 Allowed 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.971 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.671 ' HG2' ' OG ' ' A' ' 36' ' ' SER . 1.9 tptm -51.69 89.0 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.964 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 67.2 mtp -124.21 165.49 17.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.871 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.846 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 34.7 tpp -111.57 152.28 27.76 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 111.395 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 25' ' ' MET . 10.6 tt0 -94.03 109.98 21.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.665 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.788 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 43.1 t -62.26 158.52 16.99 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.521 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.13 -18.84 18.48 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.544 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.89 -55.98 3.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.77 0.319 . . . . 0.0 110.643 179.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.5 p -105.4 -2.65 23.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.01 0.433 . . . . 0.0 110.634 179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.788 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 58.68 14.42 3.13 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.938 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.664 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 8.8 mtt180 -75.25 152.78 38.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 121.282 0.563 . . . . 0.0 110.55 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.886 ' HB2' ' HA ' ' A' ' 6' ' ' ASN . 61.9 m95 -91.03 123.83 34.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.982 179.494 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.876 HG13 ' HD2' ' A' ' 9' ' ' PRO . 4.9 t -111.63 141.71 26.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.707 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.763 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.1 OUTLIER -59.18 120.66 9.62 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.068 0.461 . . . . 0.0 110.469 -179.665 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.782 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 23.1 p -56.72 -47.96 78.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.312 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.51 -39.14 62.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.846 0.355 . . . . 0.0 111.78 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.725 ' HB3' HD12 ' A' ' 10' ' ' LEU . 65.2 m -64.79 -38.86 92.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.411 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.604 ' OE1' HG11 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -79.33 18.27 0.72 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.806 0.336 . . . . 0.0 111.197 179.494 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.7 m120 55.89 32.48 19.79 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.395 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.782 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.8 mt -83.85 107.36 16.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.692 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.743 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.4 m -64.85 148.96 50.35 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -60.17 -41.66 93.35 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.228 0.537 . . . . 0.0 111.639 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.406 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.72 -49.99 68.7 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.806 0.812 . . . . 0.0 110.015 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.895 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.82 -35.08 79.94 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.357 -1.292 . . . . 0.0 108.782 179.187 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.581 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 26.9 t80 -70.1 -31.58 69.21 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.351 177.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -72.36 -36.55 68.79 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.978 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.2 mt -57.93 -38.63 67.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.153 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.87 -40.68 68.8 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.603 0.716 . . . . 0.0 109.483 178.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.1 m -69.6 -18.39 63.61 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.402 -1.272 . . . . 0.0 112.152 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -96.14 -23.62 16.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 110.22 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.87 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -65.53 162.84 38.84 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-O 121.556 0.693 . . . . 0.0 110.915 179.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.672 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.1 Cg_endo -84.26 17.75 1.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 123.617 2.878 . . . . 0.0 112.779 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 2.5 mm-40 83.86 7.81 0.6 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.145 0.578 . . . . 0.0 111.703 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.66 ' OG ' ' HG2' ' A' ' 53' ' ' PRO . 3.8 m -61.72 -31.18 71.32 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.643 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.87 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -83.33 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.982 0 CA-C-O 121.776 0.798 . . . . 0.0 110.349 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.762 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.93 131.24 17.51 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.165 -1.379 . . . . 0.0 110.219 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.822 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 32.9 t80 -95.39 116.54 28.93 Favored 'General case' 0 CA--C 1.506 -0.741 0 C-N-CA 120.357 -0.537 . . . . 0.0 109.555 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.425 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.93 131.53 54.44 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.559 -179.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.432 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.3 p -75.6 161.25 29.29 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.275 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.3 p -52.51 -42.1 38.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -177.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -64.11 -44.27 92.79 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.531 -179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 56.1 m -68.97 -39.66 79.32 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.23 -0.655 . . . . 0.0 109.23 178.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.65 0.37 17.84 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.02 179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 7.1 0.55 Allowed 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 179.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 64' ' ' THR . 13.4 ttm180 -166.05 120.42 1.17 Allowed 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.757 0.313 . . . . 0.0 110.459 179.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 2.3 p -143.01 139.66 30.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.835 0.35 . . . . 0.0 110.968 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 49.55 97.06 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.41 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.5 pttt -116.35 159.32 22.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.093 0.473 . . . . 0.0 111.122 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 104.56 -138.02 13.92 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.912 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.783 ' H ' ' HG3' ' A' ' 32' ' ' ARG . 13.5 m120 64.96 58.79 0.9 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.319 0.581 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.755 ' HA ' ' CE ' ' A' ' 24' ' ' MET . 33.2 m-85 -156.87 167.77 29.48 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.203 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.753 ' HB3' ' CA ' ' A' ' 12' ' ' ASP . 13.6 t -60.92 117.84 29.54 Favored Pre-proline 0 CA--C 1.53 0.204 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.826 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.551 ' HD2' HG13 ' A' ' 34' ' ' VAL . 43.2 Cg_endo -68.51 -6.03 16.66 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.198 2.599 . . . . 0.0 112.559 -179.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.02 -49.4 6.23 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.79 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.3 p -156.1 -42.48 0.08 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.851 0.358 . . . . 0.0 111.412 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.753 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.9 p30 50.74 22.06 1.05 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.566 -179.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.57 ' HD3' ' CG ' ' A' ' 16' ' ' ASP . 0.8 OUTLIER 67.45 -19.91 0.12 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.868 -179.908 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.65 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.9 OUTLIER 62.02 124.84 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.187 179.322 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 19.6 m-85 82.5 -26.04 0.14 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.413 0.625 . . . . 0.0 111.08 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.57 ' CG ' ' HD3' ' A' ' 13' ' ' LYS . 4.5 t0 -38.93 100.23 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.008 -0.997 . . . . 0.0 112.936 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -86.84 -5.4 59.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.314 178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.464 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 46.5 m-20 -104.6 35.54 2.71 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.931 0.396 . . . . 0.0 110.741 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.616 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 13.5 p-10 -65.19 -15.13 62.12 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.926 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.464 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 4.8 p90 -69.96 -40.36 75.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.704 0.764 . . . . 0.0 109.662 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.417 ' C ' ' H ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -105.05 -3.82 22.71 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.343 178.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.522 ' CB ' ' HA ' ' A' ' 19' ' ' ASP . 5.5 t -69.54 11.69 0.24 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.699 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 36' ' ' SER . 1.1 tptt 63.53 65.76 0.73 Allowed 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.795 0.331 . . . . 0.0 111.276 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.755 ' CE ' ' HA ' ' A' ' 7' ' ' PHE . 41.3 mtp -123.02 161.85 23.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.242 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.791 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 42.3 tpp -111.44 152.31 27.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.091 -0.504 . . . . 0.0 112.006 -179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' A' ' 25' ' ' MET . 9.1 tt0 -97.65 110.73 23.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.66 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.784 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 42.4 t -59.46 158.3 9.86 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 120.614 0.245 . . . . 0.0 110.613 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.419 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.47 -17.74 20.92 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.233 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.537 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 1.8 mttm -86.91 -57.44 2.97 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.763 0.316 . . . . 0.0 110.289 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.729 ' HB2' ' HE ' ' A' ' 32' ' ' ARG . 28.4 p -106.33 -1.62 23.18 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.113 0.482 . . . . 0.0 110.879 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.784 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 59.9 16.89 6.07 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.982 179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.783 ' HG3' ' H ' ' A' ' 6' ' ' ASN . 0.0 OUTLIER -74.93 146.46 41.77 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.036 0.446 . . . . 0.0 111.183 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.783 ' HA ' ' O ' ' A' ' 25' ' ' MET . 88.7 m95 -86.79 122.65 30.97 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.595 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.551 HG13 ' HD2' ' A' ' 9' ' ' PRO . 21.2 t -111.36 144.02 20.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.793 0.33 . . . . 0.0 110.826 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.681 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -58.7 121.01 9.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.336 179.653 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.886 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 1.9 p -60.44 -47.78 84.63 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -39.98 25.32 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.946 -0.471 . . . . 0.0 112.219 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.444 ' HB2' ' HB3' ' A' ' 35' ' ' HIS . 0.5 OUTLIER -61.92 -45.32 94.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.531 -179.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.63 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -70.48 11.81 0.31 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 120.693 0.282 . . . . 0.0 111.116 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 38' ' ' CYS . 4.2 t-20 64.47 29.5 13.32 Favored 'General case' 0 C--O 1.23 0.074 0 O-C-N 122.191 -0.318 . . . . 0.0 111.512 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.886 ' HB2' ' O ' ' A' ' 36' ' ' SER . 8.6 mt -83.58 105.9 14.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.965 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.746 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.8 OUTLIER -61.34 148.47 41.28 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.98 -41.81 97.17 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.226 0.536 . . . . 0.0 111.7 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -49.88 68.69 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.747 0.784 . . . . 0.0 110.024 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.901 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.71 -35.87 82.46 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.446 -1.252 . . . . 0.0 108.797 179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.56 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 20.2 t80 -70.01 -31.54 69.25 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.811 177.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -72.04 -36.28 69.58 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.007 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.901 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.7 mt -58.06 -41.0 79.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.045 -179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.717 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -68.96 -41.74 77.55 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.509 0.671 . . . . 0.0 109.85 178.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.2 m -69.29 -17.05 63.69 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.202 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -97.45 -23.71 15.93 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.042 0.449 . . . . 0.0 110.274 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.893 HD13 HG21 ' A' ' 56' ' ' VAL . 0.6 OUTLIER -65.39 162.97 36.51 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-O 121.463 0.649 . . . . 0.0 110.407 178.951 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.636 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 43.9 Cg_endo -83.39 17.91 1.59 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.409 2.74 . . . . 0.0 112.671 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.636 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.5 mm-40 82.88 13.32 0.44 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.275 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.08 -32.14 73.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.822 0.344 . . . . 0.0 110.395 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.893 HG21 HD13 ' A' ' 52' ' ' LEU . 1.2 t -82.67 -177.78 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 CA-C-O 121.844 0.83 . . . . 0.0 110.168 179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.747 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.57 130.13 16.89 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.132 -1.395 . . . . 0.0 109.99 178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.791 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 22.2 t80 -94.52 116.69 29.08 Favored 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.532 ' CG2' ' HD2' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.64 131.16 54.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.487 -179.463 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 21.2 p -75.58 160.38 30.2 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.162 -178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.524 HG12 ' HG3' ' A' ' 9' ' ' PRO . 3.7 p -52.25 -41.82 35.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.57 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.88 -43.89 94.68 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.931 0.396 . . . . 0.0 111.491 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.537 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 19.6 m -68.72 -40.01 80.13 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 121.479 0.657 . . . . 0.0 109.501 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -3.84 36.5 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.1 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 96.13 0.23 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.694 0.283 . . . . 0.0 110.873 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.561 ' CB ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -168.25 -56.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.969 0.414 . . . . 0.0 110.907 179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.9 p80 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.679 -179.832 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.769 -0.132 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 11.3 p -156.62 -72.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.713 0.292 . . . . 0.0 111.234 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.85 158.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.97 0.414 . . . . 0.0 111.105 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' H ' ' HG3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -100.01 166.63 10.95 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.734 179.968 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.53 ' O ' ' HD2' ' A' ' 32' ' ' ARG . . . -169.93 154.44 23.42 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.099 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.944 ' HA ' ' HG3' ' A' ' 32' ' ' ARG . 12.9 p30 -168.3 94.31 0.37 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.949 0.404 . . . . 0.0 111.465 178.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -163.4 160.07 23.06 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.784 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 6.6 t -58.96 115.81 13.32 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.099 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.931 ' HD2' HG13 ' A' ' 34' ' ' VAL . 55.8 Cg_endo -70.12 -4.02 13.43 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 123.088 2.525 . . . . 0.0 112.713 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.806 HD12 ' HB3' ' A' ' 38' ' ' CYS . 7.5 mt -91.66 -49.28 6.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.706 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 p -156.34 -43.16 0.07 Allowed 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.066 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.74 ' HB3' ' HB3' ' A' ' 8' ' ' CYS . 2.8 p30 49.23 28.18 2.13 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.48 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.937 ' HB3' ' HB2' ' A' ' 16' ' ' ASP . 0.2 OUTLIER 60.35 139.77 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.958 179.082 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.628 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -73.22 87.22 1.44 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.376 179.584 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.628 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.9 m-85 77.77 -44.83 0.43 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.492 0.663 . . . . 0.0 110.027 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.937 ' HB2' ' HB3' ' A' ' 13' ' ' LYS . 29.1 t0 54.25 167.57 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.884 -1.053 . . . . 0.0 112.046 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -134.53 -2.93 2.68 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.374 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.592 ' HA ' ' CE2' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -131.56 47.59 2.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.682 0.277 . . . . 0.0 111.505 -179.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.875 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 3.1 m-20 -65.57 -17.05 64.29 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.961 0.41 . . . . 0.0 111.226 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.592 ' CE2' ' HA ' ' A' ' 18' ' ' ASP . 8.8 p90 -70.55 -41.84 71.94 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.704 0.764 . . . . 0.0 109.134 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -91.9 -4.11 55.14 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.901 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.875 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -67.61 98.19 0.67 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 121.265 0.555 . . . . 0.0 110.467 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.89 85.85 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.558 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.457 ' HE3' ' H ' ' A' ' 8' ' ' CYS . 91.0 mtp -111.91 159.22 18.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.62 -0.263 . . . . 0.0 110.747 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.764 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 5.2 tpp -111.93 149.52 31.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.029 0.442 . . . . 0.0 111.402 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -94.79 110.24 22.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.288 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.796 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 51.8 t -60.42 158.33 12.21 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.677 0.275 . . . . 0.0 110.764 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -102.26 -17.39 20.22 Favored Glycine 0 CA--C 1.516 0.138 0 C-N-CA 120.395 -0.907 . . . . 0.0 112.165 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HD2' ' HB3' ' A' ' 63' ' ' CYS . 44.4 mttm -87.48 -56.53 3.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.734 0.302 . . . . 0.0 110.451 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.478 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.8 p -110.18 5.87 22.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.546 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.796 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.6 p30 50.97 22.34 1.17 Allowed 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.085 -0.507 . . . . 0.0 112.064 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.944 ' HG3' ' HA ' ' A' ' 6' ' ' ASN . 2.5 tpt180 -75.13 145.64 42.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.624 178.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.752 ' HA ' ' O ' ' A' ' 25' ' ' MET . 73.2 m95 -87.6 120.69 29.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.29 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.931 HG13 ' HD2' ' A' ' 9' ' ' PRO . 3.9 t -111.74 142.23 24.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 110.534 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.784 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -61.22 120.69 10.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.774 0.321 . . . . 0.0 110.282 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.957 ' HA ' HD12 ' A' ' 41' ' ' LEU . 9.3 p -58.32 -49.04 78.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.993 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -70.54 -37.34 74.05 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.719 0.295 . . . . 0.0 111.524 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.806 ' HB3' HD12 ' A' ' 10' ' ' LEU . 67.5 m -70.23 -35.42 73.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.381 -179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.468 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 0.6 OUTLIER -84.39 17.44 2.61 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.143 179.682 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.3 m-20 57.66 35.41 25.62 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.731 0.3 . . . . 0.0 111.176 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.957 HD12 ' HA ' ' A' ' 36' ' ' SER . 17.8 mt -83.43 97.6 9.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.722 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.753 ' O ' ' HG3' ' A' ' 45' ' ' MET . 1.2 m -60.21 148.61 35.78 Favored 'General case' 0 C--O 1.226 -0.166 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.51 -42.32 96.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.28 0.562 . . . . 0.0 111.5 -179.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.37 67.41 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.955 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.86 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -63.93 -36.46 84.02 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.705 178.847 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.567 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.5 t80 -69.48 -31.68 70.11 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.751 178.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -72.16 -36.12 69.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.901 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.86 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -57.97 -39.4 71.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.284 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.675 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -71.23 -39.55 71.63 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.473 0.654 . . . . 0.0 109.709 179.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 m -69.04 -19.1 64.1 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.228 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -97.15 -23.34 16.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.099 0.476 . . . . 0.0 110.568 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.875 HD13 HG21 ' A' ' 56' ' ' VAL . 0.9 OUTLIER -66.4 162.66 47.09 Favored Pre-proline 0 N--CA 1.449 -0.495 0 CA-C-O 121.636 0.732 . . . . 0.0 111.307 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.704 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 47.3 Cg_endo -84.08 15.35 2.18 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 123.641 2.894 . . . . 0.0 112.686 -179.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.704 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 0.9 OUTLIER 86.14 7.84 0.32 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.255 0.622 . . . . 0.0 111.654 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.97 -32.55 72.09 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.645 0.259 . . . . 0.0 110.491 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.875 HG21 HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -82.34 -179.46 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-O 121.857 0.837 . . . . 0.0 110.221 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.742 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.5 130.21 17.03 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-N 114.235 -1.348 . . . . 0.0 110.081 178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.774 ' HE2' HD21 ' A' ' 41' ' ' LEU . 26.1 t80 -96.04 115.42 27.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.466 HG22 ' CB ' ' A' ' 63' ' ' CYS . 0.2 OUTLIER -107.43 132.06 53.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.721 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.432 ' CB ' HG21 ' A' ' 34' ' ' VAL . 19.8 p -75.22 159.35 31.66 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.044 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' CG2' ' HA ' ' A' ' 66' ' ' ARG . 3.2 p -52.67 -42.26 40.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -177.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -63.79 -41.36 97.93 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.422 -0.511 . . . . 0.0 111.165 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.553 ' HB3' ' HD2' ' A' ' 29' ' ' LYS . 2.3 m -68.79 -41.11 79.18 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.635 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.722 HG22 ' N ' ' A' ' 65' ' ' GLU . 0.9 OUTLIER -76.66 -75.83 0.18 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.476 -179.563 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.722 ' N ' HG22 ' A' ' 64' ' ' THR . 3.0 pt-20 -175.64 126.38 0.23 Allowed 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.782 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.433 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . 0.6 OUTLIER -74.81 -9.01 58.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.427 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.711 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.506 -0.238 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 3.1 t -138.92 141.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.79 0.328 . . . . 0.0 110.948 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.71 105.38 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.997 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.614 ' HE3' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -135.24 96.85 3.57 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.687 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.04 -100.79 2.44 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.143 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.719 ' OD1' ' HA ' ' A' ' 32' ' ' ARG . 0.6 OUTLIER 69.2 142.67 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.98 0.419 . . . . 0.0 110.868 179.749 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.474 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 1.7 p90 -163.85 150.08 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.763 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.77 152.36 19.75 Favored Pre-proline 0 N--CA 1.448 -0.538 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.633 -179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.94 ' HG2' HG12 ' A' ' 61' ' ' VAL . 9.2 Cg_endo -88.28 1.23 6.59 Favored 'Trans proline' 0 CA--C 1.531 0.349 0 C-N-CA 124.271 3.314 . . . . 0.0 114.542 -177.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.7 HD12 ' SG ' ' A' ' 38' ' ' CYS . 0.2 OUTLIER -106.48 -59.86 1.74 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.082 0.468 . . . . 0.0 110.811 -179.697 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.2 p -139.48 -51.98 0.53 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.018 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.813 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 5.0 p-10 47.8 28.49 1.35 Allowed 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.197 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.954 ' HE3' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 60.09 140.19 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.902 178.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.652 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 6.8 t -70.62 72.78 0.53 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.324 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.652 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 23.1 m-85 83.69 -39.91 0.08 Allowed 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.553 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.887 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 2.4 p30 49.41 177.45 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.896 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -131.72 -7.07 3.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.423 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.749 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 2.4 p30 -123.3 43.77 2.86 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-O 121.059 0.457 . . . . 0.0 110.642 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 22' ' ' SER . 1.5 p30 -65.43 -17.58 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.749 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 16.5 p90 -69.84 -53.09 19.75 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.847 0.832 . . . . 0.0 109.809 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.648 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 5.0 pt-20 -84.64 -0.95 55.26 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.159 -1.382 . . . . 0.0 109.89 178.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.554 ' HB2' ' HA ' ' A' ' 19' ' ' ASP . 1.4 m -67.57 97.87 0.63 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.925 179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.4 ' O ' ' HB3' ' A' ' 36' ' ' SER . 8.2 tptm -52.83 90.46 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.476 -179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 33' ' ' TRP . 69.5 mtp -109.5 161.8 14.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.205 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.732 ' HG2' ' CE2' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -109.8 131.56 54.95 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.575 -179.816 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -86.32 109.63 19.11 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.934 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.807 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 44.8 t -62.16 158.32 17.18 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.78 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.71 -17.67 20.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.272 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.602 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -86.77 -57.39 3.0 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.737 0.303 . . . . 0.0 110.404 179.848 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 29.5 p -109.71 2.44 20.12 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.042 0.448 . . . . 0.0 110.645 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.807 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.1 OUTLIER 58.47 14.84 3.18 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.235 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.719 ' HA ' ' OD1' ' A' ' 6' ' ' ASN . 19.1 mtt180 -71.27 148.43 47.19 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.21 0.528 . . . . 0.0 111.419 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.714 ' HA ' ' O ' ' A' ' 25' ' ' MET . 91.0 m95 -88.69 120.94 30.55 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.625 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.65 HG13 ' CD ' ' A' ' 9' ' ' PRO . 3.2 t -110.53 144.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.813 ' CE1' ' HA ' ' A' ' 12' ' ' ASP . 0.1 OUTLIER -59.49 120.1 8.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.966 0.412 . . . . 0.0 110.73 -178.752 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.863 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 9.6 p -60.16 -45.44 93.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.18 0.514 . . . . 0.0 110.766 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.58 -47.87 14.77 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.71 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.7 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -63.13 -36.44 83.63 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.447 -179.223 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.619 ' HG2' ' OH ' ' A' ' 58' ' ' TYR . 10.0 tp10 -72.59 7.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.668 0.27 . . . . 0.0 111.193 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 65.15 30.21 11.57 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.644 0.259 . . . . 0.0 111.372 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.863 ' HB2' ' O ' ' A' ' 36' ' ' SER . 16.5 mt -83.67 111.26 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.208 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.763 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 0.2 OUTLIER -65.42 148.31 51.93 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.454 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 -41.75 99.54 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.19 0.519 . . . . 0.0 111.888 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.81 -50.15 67.85 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.203 179.81 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.876 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -65.15 -35.67 81.82 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 114.542 -1.208 . . . . 0.0 108.665 179.15 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.732 ' CE2' ' HG2' ' A' ' 25' ' ' MET . 2.2 t80 -69.27 -32.31 71.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.428 177.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -71.48 -36.03 71.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.046 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.876 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.0 mt -58.32 -39.08 72.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.201 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.89 -40.48 72.2 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.523 0.677 . . . . 0.0 109.893 178.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 m -69.44 -17.1 63.61 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.978 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -97.94 -23.34 15.86 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 0.0 110.314 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.847 HD13 HG21 ' A' ' 56' ' ' VAL . 0.4 OUTLIER -65.01 162.28 40.04 Favored Pre-proline 0 N--CA 1.447 -0.624 0 CA-C-O 121.636 0.731 . . . . 0.0 110.891 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.651 ' HD2' HD23 ' A' ' 52' ' ' LEU . 46.0 Cg_endo -82.39 43.16 1.44 Allowed 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.548 2.832 . . . . 0.0 111.414 179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 48.67 24.04 0.73 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.849 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.2 t -76.28 -29.2 57.33 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.847 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.73 -179.04 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.107 0 CA-C-O 121.592 0.711 . . . . 0.0 109.676 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.713 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.02 130.07 16.38 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.372 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.861 ' CE2' HD11 ' A' ' 41' ' ' LEU . 25.3 t80 -90.94 118.83 30.65 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 131.64 54.01 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.764 -179.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.52 ' O ' ' HB ' ' A' ' 64' ' ' THR . 21.9 p -75.6 163.81 26.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.311 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.94 HG12 ' HG2' ' A' ' 9' ' ' PRO . 4.4 p -53.35 -42.17 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -177.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -63.55 -44.81 93.1 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.978 0.418 . . . . 0.0 111.368 -178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 57.3 m -69.58 -39.7 77.18 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 178.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.52 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.05 -10.46 59.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.045 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 56.71 167.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.397 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 ttt-85 62.94 162.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.952 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.514 179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 CA-C-O 120.286 -0.175 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.53 84.14 0.13 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.981 0.419 . . . . 0.0 110.898 179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 60.51 174.41 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.9 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -165.53 121.9 1.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.68 132.3 3.29 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.007 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.767 ' HB3' ' H ' ' A' ' 33' ' ' TRP . 2.5 m-20 63.04 106.36 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.947 0.403 . . . . 0.0 111.086 179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -170.8 151.75 3.52 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.372 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.775 ' SG ' ' HB2' ' A' ' 35' ' ' HIS . 7.6 t -59.23 115.85 13.77 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.791 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.891 ' HD2' HG13 ' A' ' 34' ' ' VAL . 56.2 Cg_endo -70.73 -3.28 12.34 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.776 2.318 . . . . 0.0 112.755 -179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.669 HD12 ' HB3' ' A' ' 38' ' ' CYS . 11.5 mt -91.89 -49.48 6.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.734 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 31.2 p -156.19 -41.44 0.08 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.728 ' CA ' ' HB3' ' A' ' 8' ' ' CYS . 3.8 p30 49.11 26.53 1.46 Allowed 'General case' 0 CA--C 1.516 -0.361 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.689 -179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HE2' ' O ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER 62.96 -1.41 0.49 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.478 179.421 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.651 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.7 OUTLIER 79.98 103.34 0.07 Allowed 'General case' 0 N--CA 1.462 0.126 0 O-C-N 122.377 -0.202 . . . . 0.0 110.844 179.578 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.651 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 4.4 m-85 81.28 -42.56 0.17 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.386 0.612 . . . . 0.0 110.883 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 t0 53.17 93.83 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.36 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -93.77 -5.76 47.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.907 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.735 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 6.9 p-10 -141.6 47.19 1.67 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.107 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.484 ' HA ' ' CB ' ' A' ' 22' ' ' SER . 2.7 p30 -65.08 -14.26 60.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.965 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.735 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 6.3 p90 -69.78 -40.54 75.99 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.644 0.735 . . . . 0.0 109.654 179.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.418 ' HG2' ' CE2' ' A' ' 20' ' ' TYR . 1.3 pt-20 -106.6 -5.07 18.95 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.516 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.54 ' HB2' ' O ' ' A' ' 18' ' ' ASP . 3.3 t -71.27 5.92 1.97 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.363 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.44 58.11 1.4 Allowed 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 120.805 0.336 . . . . 0.0 111.551 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.565 ' HE3' ' HB2' ' A' ' 8' ' ' CYS . 9.9 mtp -109.84 160.65 16.18 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.51 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.748 ' O ' ' HA ' ' A' ' 33' ' ' TRP . 36.9 tpp -110.35 151.9 26.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.994 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -93.7 110.41 22.03 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.353 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.779 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 38.9 t -64.2 156.87 27.29 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.623 0.249 . . . . 0.0 110.727 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.517 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -101.94 -16.94 22.31 Favored Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.426 -0.892 . . . . 0.0 112.415 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.625 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.1 OUTLIER -86.47 -56.13 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.452 0.168 . . . . 0.0 110.589 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.504 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 30.4 p -110.57 3.36 19.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.085 0.469 . . . . 0.0 110.379 179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.779 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 0.5 OUTLIER 56.74 16.68 2.78 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.018 179.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.571 ' CB ' ' HA ' ' A' ' 6' ' ' ASN . 38.6 mtt85 -75.21 150.07 38.75 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.255 0.55 . . . . 0.0 110.964 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.767 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 84.8 m95 -89.34 123.06 33.17 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.591 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.891 HG13 ' HD2' ' A' ' 9' ' ' PRO . 5.0 t -112.58 140.24 33.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.775 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.2 OUTLIER -60.62 120.6 10.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.82 0.343 . . . . 0.0 110.262 -179.101 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.766 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 60.3 p -58.0 -50.13 74.46 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.219 -179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.5 -38.5 74.34 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.763 0.316 . . . . 0.0 111.734 -178.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.669 ' HB3' HD12 ' A' ' 10' ' ' LEU . 59.7 m -67.57 -42.1 83.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.123 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.679 ' OE1' HG11 ' A' ' 34' ' ' VAL . 3.7 tp10 -76.4 18.23 0.32 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.049 0.452 . . . . 0.0 111.006 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' CYS . 9.1 t-20 57.06 32.18 21.23 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.282 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.782 HD21 ' HE2' ' A' ' 58' ' ' TYR . 10.7 mt -83.79 105.74 14.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.684 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.766 ' O ' ' HG3' ' A' ' 45' ' ' MET . 0.2 OUTLIER -64.68 148.79 50.3 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.746 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -60.77 -42.78 98.17 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 0.0 111.675 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -50.11 70.12 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.769 0.795 . . . . 0.0 109.98 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.894 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -64.63 -35.97 82.74 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.445 179.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.572 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 31.3 t80 -69.5 -31.73 70.16 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.728 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -71.83 -36.3 70.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.926 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.894 HD12 ' HA ' ' A' ' 45' ' ' MET . 6.9 mt -57.86 -40.86 78.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.119 -178.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.712 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -69.13 -41.95 76.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.673 178.248 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.47 -16.25 63.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.7 -1.136 . . . . 0.0 112.122 -179.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -96.58 -23.97 16.26 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.11 0.481 . . . . 0.0 110.256 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.83 HD13 HG21 ' A' ' 56' ' ' VAL . 0.7 OUTLIER -66.84 162.64 50.67 Favored Pre-proline 0 N--CA 1.445 -0.698 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.565 179.304 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.678 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 49.6 Cg_endo -83.18 15.2 2.16 Favored 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 123.366 2.71 . . . . 0.0 112.459 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.678 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 24.9 mt-10 85.62 11.73 0.23 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.265 0.626 . . . . 0.0 111.755 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.1 m -63.71 -31.97 73.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.861 0.363 . . . . 0.0 110.271 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.83 HG21 HD13 ' A' ' 52' ' ' LEU . 1.5 t -82.23 179.66 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.796 0.808 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.763 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -146.46 130.46 17.29 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 114.37 -1.287 . . . . 0.0 110.234 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.782 ' HE2' HD21 ' A' ' 41' ' ' LEU . 29.0 t80 -95.93 119.05 33.72 Favored 'General case' 0 CA--C 1.509 -0.619 0 C-N-CA 120.195 -0.602 . . . . 0.0 109.422 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.458 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 1.6 m -107.5 131.83 53.89 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.464 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 15.8 p -75.29 155.22 36.88 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 121.214 0.531 . . . . 0.0 109.893 -178.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.436 ' HA ' ' OG1' ' A' ' 64' ' ' THR . 4.9 p -52.32 -42.03 36.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -65.37 -39.51 92.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.954 0.407 . . . . 0.0 111.561 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 11.6 m -68.67 -40.87 79.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.355 0.597 . . . . 0.0 109.824 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 1.0 OUTLIER -73.93 -95.47 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.194 179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.49 ' HB2' ' O ' ' A' ' 64' ' ' THR . 2.7 mt-10 75.31 99.1 0.07 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.721 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 39.6 ttp180 -78.32 -58.09 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.825 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.454 ' H ' ' CD2' ' A' ' 67' ' ' HIS . 7.9 p80 . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.909 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' SER . . . . . . . . . . . . . 4.6 m 59.28 91.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.928 0.394 . . . . 0.0 111.189 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -142.54 -30.24 0.55 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.237 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.11 175.15 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.332 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 142.77 82.74 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.17 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -74.62 109.18 7.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.702 0.287 . . . . 0.0 110.768 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.573 ' HA ' ' OD2' ' A' ' 12' ' ' ASP . 0.2 OUTLIER -161.82 113.59 1.72 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.919 0.39 . . . . 0.0 111.714 -179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.83 ' HB2' ' H ' ' A' ' 35' ' ' HIS . 0.0 OUTLIER -55.59 163.91 1.75 Allowed Pre-proline 0 CA--C 1.538 0.501 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.809 179.741 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.88 ' CD ' HG13 ' A' ' 34' ' ' VAL . 23.7 Cg_endo -94.9 -0.14 2.65 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 124.054 3.169 . . . . 0.0 115.009 -176.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.662 ' N ' HD23 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -111.68 -53.35 2.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.293 0.568 . . . . 0.0 110.423 179.463 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 12' ' ' ASP . 2.2 p -143.34 -65.56 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.044 -179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.782 ' HA ' ' CE1' ' A' ' 35' ' ' HIS . 35.1 t70 68.26 37.13 2.89 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.927 179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 1.052 ' HB3' ' HB3' ' A' ' 16' ' ' ASP . 0.0 OUTLIER 62.3 144.81 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.436 179.723 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.659 ' O ' ' HB2' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -68.95 91.64 0.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.745 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.659 ' HB2' ' O ' ' A' ' 14' ' ' CYS . 10.7 m-85 81.38 -39.21 0.13 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.502 0.668 . . . . 0.0 109.608 -178.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 1.052 ' HB3' ' HB3' ' A' ' 13' ' ' LYS . 6.9 p-10 44.41 101.5 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.536 178.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -89.01 -4.21 58.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.788 179.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.879 ' HA ' ' CE1' ' A' ' 20' ' ' TYR . 62.2 m-20 -116.24 41.66 2.57 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.08 0.467 . . . . 0.0 111.13 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.596 ' HA ' ' OG ' ' A' ' 22' ' ' SER . 6.7 t70 -65.5 -14.79 61.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.311 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.879 ' CE1' ' HA ' ' A' ' 18' ' ' ASP . 9.1 p90 -70.17 -40.87 74.42 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 121.735 0.779 . . . . 0.0 109.367 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -96.72 -3.22 42.9 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.905 178.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.596 ' OG ' ' HA ' ' A' ' 19' ' ' ASP . 58.8 m -67.67 97.75 0.64 Allowed 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.537 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.36 85.6 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.579 -179.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.604 ' HE3' ' H ' ' A' ' 8' ' ' CYS . 92.8 mtp -115.16 163.74 15.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.751 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' MET . . . . . 0.811 ' HG2' ' CD2' ' A' ' 58' ' ' TYR . 32.8 tpp -109.78 151.36 27.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.113 0.482 . . . . 0.0 112.043 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -94.91 110.43 22.32 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.533 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 31' ' ' ASP . 40.7 t -61.35 157.37 16.78 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 120.72 0.295 . . . . 0.0 110.603 179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' TYR . . . -100.68 -18.01 21.95 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' HB3' ' SG ' ' A' ' 63' ' ' CYS . 0.0 OUTLIER -87.01 -55.42 3.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.686 0.279 . . . . 0.0 110.8 179.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.565 ' SG ' ' HB2' ' A' ' 32' ' ' ARG . 27.2 p -110.01 -1.83 17.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.943 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.725 ' HA ' ' O ' ' A' ' 27' ' ' CYS . 1.0 OUTLIER 62.48 15.74 8.09 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.834 179.715 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.565 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -72.97 145.32 46.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.213 0.53 . . . . 0.0 110.754 179.771 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.773 ' HA ' ' O ' ' A' ' 25' ' ' MET . 77.1 m95 -86.56 122.29 30.29 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.352 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.88 HG13 ' CD ' ' A' ' 9' ' ' PRO . 14.0 t -111.13 147.74 14.93 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.968 0.413 . . . . 0.0 110.388 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.83 ' H ' ' HB2' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -61.19 120.09 9.68 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.106 -179.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.849 ' O ' ' HB2' ' A' ' 41' ' ' LEU . 30.1 p -60.88 -46.35 90.94 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.263 0.554 . . . . 0.0 110.926 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -80.87 -46.55 15.09 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.105 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.56 ' SG ' HD12 ' A' ' 10' ' ' LEU . 0.0 OUTLIER -63.46 -36.56 84.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.217 -179.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.631 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 28.3 tp10 -74.26 9.98 1.44 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 120.629 0.252 . . . . 0.0 111.207 179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 10.0 m120 64.0 28.23 14.36 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.687 0.28 . . . . 0.0 111.723 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.849 ' HB2' ' O ' ' A' ' 36' ' ' SER . 6.7 mt -83.52 107.47 16.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.272 179.711 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.992 ' HB2' ' HG2' ' A' ' 45' ' ' MET . 2.8 m -62.97 148.84 46.39 Favored 'General case' 0 N--CA 1.462 0.133 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -60.43 -41.91 94.97 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.272 0.558 . . . . 0.0 111.548 -179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.403 ' CG ' ' N ' ' A' ' 45' ' ' MET . 0.0 OUTLIER -64.86 -50.27 67.26 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.972 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.992 ' HG2' ' HB2' ' A' ' 42' ' ' SER . 0.0 OUTLIER -64.29 -35.09 79.73 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.295 -1.32 . . . . 0.0 108.673 179.094 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 49' ' ' LEU . 32.2 t80 -70.28 -32.67 70.57 Favored 'General case' 0 N--CA 1.457 -0.112 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.777 177.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.14 -36.36 72.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.871 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 45' ' ' MET . 5.8 mt -58.03 -40.46 76.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.705 HD13 ' N ' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -70.81 -42.63 70.04 Favored 'General case' 0 CA--C 1.518 -0.263 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.058 178.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.19 -15.5 63.41 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.782 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -98.5 -23.26 15.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.093 0.473 . . . . 0.0 110.265 179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.894 HD13 HG21 ' A' ' 56' ' ' VAL . 0.8 OUTLIER -65.14 162.86 35.71 Favored Pre-proline 0 N--CA 1.445 -0.722 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.669 179.498 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 40.0 Cg_endo -84.0 16.1 2.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.321 2.681 . . . . 0.0 112.631 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.677 ' HB2' ' O ' ' A' ' 53' ' ' PRO . 3.7 mm-40 84.48 11.81 0.33 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.15 0.58 . . . . 0.0 111.902 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.38 -31.28 71.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.899 0.38 . . . . 0.0 110.278 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.894 HG21 HD13 ' A' ' 52' ' ' LEU . 1.3 t -83.03 -178.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 121.9 0.857 . . . . 0.0 110.226 179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.775 ' H ' HG12 ' A' ' 56' ' ' VAL . . . -147.15 131.5 17.55 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.19 -1.368 . . . . 0.0 110.283 179.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.811 ' CD2' ' HG2' ' A' ' 25' ' ' MET . 24.6 t80 -95.78 116.25 28.61 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.487 ' CG2' ' HD3' ' A' ' 29' ' ' LYS . 0.3 OUTLIER -107.05 131.45 54.08 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.702 -179.096 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.543 ' O ' ' HB ' ' A' ' 64' ' ' THR . 19.4 p -75.25 164.02 26.89 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.58 -178.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.79 HG12 ' HG2' ' A' ' 9' ' ' PRO . 4.5 p -52.73 -42.27 41.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -177.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -65.04 -44.23 89.77 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.036 0.445 . . . . 0.0 111.391 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 29' ' ' LYS . 67.2 m -69.14 -39.8 78.62 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.462 0.648 . . . . 0.0 109.264 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.543 ' HB ' ' O ' ' A' ' 60' ' ' CYS . 0.8 OUTLIER -75.33 -7.97 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.77 -1.105 . . . . 0.0 111.068 179.878 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 45.69 101.34 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.047 0.451 . . . . 0.0 112.128 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.421 HH21 ' CD2' ' A' ' 67' ' ' HIS . 0.0 OUTLIER -72.84 -14.54 61.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.001 179.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.421 ' CD2' HH21 ' A' ' 66' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.334 -0.078 0 CA-C-O 120.714 0.292 . . . . 0.0 110.731 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_